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Product No: BT8575

(2S)-2-(6-Methoxynaphth-2-yl)propanoic acid, 98%

Name: (2S)-2-(6-Methoxynaphth-2-yl)propanoic acid
Brand: Chempure
Rating: 4 (1 reviews)

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CAS Number

22204-53-1

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IUPAC name	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid
canonical smiles	CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O
inchi	InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1
inchi key	CMWTZPSULFXXJA-VIFPVBQESA-N
molecular formula	C14H14O3
synonyms	NAPROXEN 22204-53-1 (S)-Naproxen Naprosyn (+)-Naproxen
Compound Description	Naproxen is a methoxynaphthalene that is 2-methoxynaphthalene substituted by a carboxy ethyl group at position 6. Naproxen is a non-steroidal anti-inflammatory drug commonly used for the reduction of pain, fever, inflammation and stiffness caused by conditions such as osteoarthritis, kidney stones, rheumatoid arthritis, psoriatic arthritis, gout, ankylosing spondylitis, menstrual cramps, tendinitis, bursitis, and for the treatment of primary dysmenorrhea. It works by inhibiting both the COX-1 and COX-2 enzymes. It has a role as a non-steroidal anti-inflammatory drug, an antipyretic, a cyclooxygenase 2 inhibitor, a cyclooxygenase 1 inhibitor, a non-narcotic analgesic, a gout suppressant, a xenobiotic, an environmental contaminant and a drug allergen. It is a monocarboxylic acid and a methoxynaphthalene. It is a conjugate acid of a naproxen. Naproxen is classified as a nonsteroidal anti-inflammatory dug and was initially approved for prescription use in 1976 and then for over-the-counter use in 1994. It can effectively manage acute pain as well as pain related to rheumatic diseases, and has a well studied adverse effect profile. Given its overall tolerability and effectiveness, naproxen can be considered a first line treatment for a variety of clinical situations requiring analgesia. Naproxen is available in both immediate and delayed release formulations, in combination with sumatriptan to treat migraines, and in combination with esomeprazole to lower the risk of developing gastric ulcers. Naproxen is a Nonsteroidal Anti-inflammatory Drug. The mechanism of action of naproxen is as a Cyclooxygenase Inhibitor. Naproxen is a popular over-the-counter nonsteroidal antiinflammatory drug that is widely used for therapy of mild-to-moderate pain and arthritis. Naproxen has been associated with rare cases of clinically apparent drug induced liver injury. Naproxen is a natural product found in Plantago major with data available. Naproxen is a propionic acid derivative and a non-steroidal anti-inflammatory drug with anti-inflammatory, antipyretic and analgesic activities. Naproxen inhibits the activity of the enzymes cyclo-oxygenase I and II, resulting in a decreased formation of precursors of prostaglandins and thromboxanes. The resulting decrease in prostaglandin synthesis is responsible for the therapeutic effects of naproxen. Naproxen also causes a decrease in the formation of thromboxane A2 synthesis, by thromboxane synthase, thereby inhibiting platelet aggregation. An anti-inflammatory agent with analgesic and antipyretic properties. Both the acid and its sodium salt are used in the treatment of rheumatoid arthritis and other rheumatic or musculoskeletal disorders, dysmenorrhea, and acute gout. See also: Naproxen Sodium ; Lansoprazole; Naproxen ; Esomeprazole Magnesium; Naproxen .

Computed Properties

Molecular Weight:	230.26 g/mol
XLogP3:	3.3
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	3
Exact Mass:	230.094294304 g/mol
Monoisotopic Mass:	230.094294304 g/mol
Topological Polar Surface Area:	46.5 Å²
Heavy Atom Count:	17
Formal Charge:	0
Complexity:	277
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	1
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Naproxen

Nabumetone

Naproxen Sodium

Methallenestril

Esflurbiprofen

6-Methoxy-2-naphthylacetic acid

O-Desmethylnaproxen

((4-Methoxybenzoyl)oxy)acetic acid

1-(6-Methoxy-2-naphthyl)propan-1-one

2-[(2R,4aR,8aR)-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid

Anaprox

Naproxen Methyl Ester

Rupestonic acid

6-Methoxy-2-oxo-1,2-dihydro-1-quinolineacetic acid

Costic acid

hazard signal	Danger
hazard classes and categories	Acute Tox. 3 (42.65%) Acute Tox. 4 (58.09%) Skin Irrit. 2 (56.62%) Eye Irrit. 2A (55.88%) STOT SE 3 (53.68%) Repr. 2 (50.74%)
precautionary statement codes	P203, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H301 (42.65%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (58.09%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (56.62%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (55.88%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (53.68%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H361 (50.74%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]

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Documentation

Certificate of Analysis

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CAS #

*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

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About this item

IUPAC name	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid
canonical smiles	CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O
inchi	InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1
inchi key	CMWTZPSULFXXJA-VIFPVBQESA-N
molecular formula	C14H14O3
synonyms	NAPROXEN 22204-53-1 (S)-Naproxen Naprosyn (+)-Naproxen
Compound Description	Naproxen is a methoxynaphthalene that is 2-methoxynaphthalene substituted by a carboxy ethyl group at position 6. Naproxen is a non-steroidal anti-inflammatory drug commonly used for the reduction of pain, fever, inflammation and stiffness caused by conditions such as osteoarthritis, kidney stones, rheumatoid arthritis, psoriatic arthritis, gout, ankylosing spondylitis, menstrual cramps, tendinitis, bursitis, and for the treatment of primary dysmenorrhea. It works by inhibiting both the COX-1 and COX-2 enzymes. It has a role as a non-steroidal anti-inflammatory drug, an antipyretic, a cyclooxygenase 2 inhibitor, a cyclooxygenase 1 inhibitor, a non-narcotic analgesic, a gout suppressant, a xenobiotic, an environmental contaminant and a drug allergen. It is a monocarboxylic acid and a methoxynaphthalene. It is a conjugate acid of a naproxen. Naproxen is classified as a nonsteroidal anti-inflammatory dug and was initially approved for prescription use in 1976 and then for over-the-counter use in 1994. It can effectively manage acute pain as well as pain related to rheumatic diseases, and has a well studied adverse effect profile. Given its overall tolerability and effectiveness, naproxen can be considered a first line treatment for a variety of clinical situations requiring analgesia. Naproxen is available in both immediate and delayed release formulations, in combination with sumatriptan to treat migraines, and in combination with esomeprazole to lower the risk of developing gastric ulcers. Naproxen is a Nonsteroidal Anti-inflammatory Drug. The mechanism of action of naproxen is as a Cyclooxygenase Inhibitor. Naproxen is a popular over-the-counter nonsteroidal antiinflammatory drug that is widely used for therapy of mild-to-moderate pain and arthritis. Naproxen has been associated with rare cases of clinically apparent drug induced liver injury. Naproxen is a natural product found in Plantago major with data available. Naproxen is a propionic acid derivative and a non-steroidal anti-inflammatory drug with anti-inflammatory, antipyretic and analgesic activities. Naproxen inhibits the activity of the enzymes cyclo-oxygenase I and II, resulting in a decreased formation of precursors of prostaglandins and thromboxanes. The resulting decrease in prostaglandin synthesis is responsible for the therapeutic effects of naproxen. Naproxen also causes a decrease in the formation of thromboxane A2 synthesis, by thromboxane synthase, thereby inhibiting platelet aggregation. An anti-inflammatory agent with analgesic and antipyretic properties. Both the acid and its sodium salt are used in the treatment of rheumatoid arthritis and other rheumatic or musculoskeletal disorders, dysmenorrhea, and acute gout. See also: Naproxen Sodium ; Lansoprazole; Naproxen ; Esomeprazole Magnesium; Naproxen .

Computed Properties

Molecular Weight:	230.26 g/mol
XLogP3:	3.3
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	3
Exact Mass:	230.094294304 g/mol
Monoisotopic Mass:	230.094294304 g/mol
Topological Polar Surface Area:	46.5 Å²
Heavy Atom Count:	17
Formal Charge:	0
Complexity:	277
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	1
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Naproxen

Nabumetone

Naproxen Sodium

Methallenestril

Esflurbiprofen

6-Methoxy-2-naphthylacetic acid

O-Desmethylnaproxen

((4-Methoxybenzoyl)oxy)acetic acid

1-(6-Methoxy-2-naphthyl)propan-1-one

2-[(2R,4aR,8aR)-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl]prop-2-enoic acid

Anaprox

Naproxen Methyl Ester

Rupestonic acid

6-Methoxy-2-oxo-1,2-dihydro-1-quinolineacetic acid

Costic acid

hazard signal	Danger
hazard classes and categories	Acute Tox. 3 (42.65%) Acute Tox. 4 (58.09%) Skin Irrit. 2 (56.62%) Eye Irrit. 2A (55.88%) STOT SE 3 (53.68%) Repr. 2 (50.74%)
precautionary statement codes	P203, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H301 (42.65%): Toxic if swallowed [Danger Acute toxicity, oral] H302 (58.09%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (56.62%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (55.88%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (53.68%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] H361 (50.74%): Suspected of damaging fertility or the unborn child [Warning Reproductive toxicity]

Product No: BT8575

(2S)-2-(6-Methoxynaphth-2-yl)propanoic acid, 98%

Product No: BT8575

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

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Product No: BT8575

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?