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Product No: AZ3503

oxane-2,6-dione, 95%

Name: oxane-2,6-dione
Brand: Chempure
Rating: 4 (1 reviews)

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CAS Number

108-55-4

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IUPAC name	oxane-2,6-dione
canonical smiles	C1CC(=O)OC(=O)C1
inchi	InChI=1S/C5H6O3/c6-4-2-1-3-5(7)8-4/h1-3H2
inchi key	VANNPISTIUFMLH-UHFFFAOYSA-N
molecular formula	C5H6O3
synonyms	GLUTARIC ANHYDRIDE 108-55-4 Dihydro-2H-pyran-2,6(3H)-dione oxane-2,6-dione Glutaric acid anhydride
Compound Description	Glutaric anhydride is a cyclic dicarboxylic anhydride that is oxane which carries oxo groups at positions 2 and 6. It is used as an intermediate in the production of pharmaceuticals, corrosion inhibitors, and polymers . It is a cyclic dicarboxylic anhydride and a member of oxanes. It is functionally related to a glutaric acid. Glutaric anhydride is a natural product found in Arabidopsis thaliana with data available.

Computed Properties

Molecular Weight:	114.10 g/mol
XLogP3:	-0.1
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	0
Exact Mass:	114.031694049 g/mol
Monoisotopic Mass:	114.031694049 g/mol
Topological Polar Surface Area:	43.4 Å²
Heavy Atom Count:	8
Formal Charge:	0
Complexity:	114
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
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

gamma-Butyrolactone

Maleic Anhydride

Cyclohexanone

Cyclopentanone

Fluorouracil

2(5H)-Furanone

5-Chloro-2-methyl-4-isothiazolin-3-one

Trichloroisocyanuric acid

2-Thiouracil

Methylthiouracil

Cyclohexene oxide

3-Acetylpyridine

Cycloheptanone

2,6-Dimethoxyphenol

Thymine

hazard signal	Danger
hazard classes and categories	Acute Tox. 4 (98.99%) Acute Tox. 4 (22.3%) Skin Irrit. 2 (100%) Eye Dam. 1 (99.32%) STOT SE 3 (58.11%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (98.99%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (22.3%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (99.32%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (58.11%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
hazards summary	Causes somnolence, necrotic gastrointestinal changes, and diffuse hepatitis in oral lethal-dose studies of rats. An irritant that may cause serious eye injury. Toxic by ingestion and skin absorption. See Acid Anhydrides.

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Documentation

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*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	oxane-2,6-dione
canonical smiles	C1CC(=O)OC(=O)C1
inchi	InChI=1S/C5H6O3/c6-4-2-1-3-5(7)8-4/h1-3H2
inchi key	VANNPISTIUFMLH-UHFFFAOYSA-N
molecular formula	C5H6O3
synonyms	GLUTARIC ANHYDRIDE 108-55-4 Dihydro-2H-pyran-2,6(3H)-dione oxane-2,6-dione Glutaric acid anhydride
Compound Description	Glutaric anhydride is a cyclic dicarboxylic anhydride that is oxane which carries oxo groups at positions 2 and 6. It is used as an intermediate in the production of pharmaceuticals, corrosion inhibitors, and polymers . It is a cyclic dicarboxylic anhydride and a member of oxanes. It is functionally related to a glutaric acid. Glutaric anhydride is a natural product found in Arabidopsis thaliana with data available.

Computed Properties

Molecular Weight:	114.10 g/mol
XLogP3:	-0.1
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	0
Exact Mass:	114.031694049 g/mol
Monoisotopic Mass:	114.031694049 g/mol
Topological Polar Surface Area:	43.4 Å²
Heavy Atom Count:	8
Formal Charge:	0
Complexity:	114
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
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

gamma-Butyrolactone

Maleic Anhydride

Cyclohexanone

Cyclopentanone

Fluorouracil

2(5H)-Furanone

5-Chloro-2-methyl-4-isothiazolin-3-one

Trichloroisocyanuric acid

2-Thiouracil

Methylthiouracil

Cyclohexene oxide

3-Acetylpyridine

Cycloheptanone

2,6-Dimethoxyphenol

Thymine

hazard signal	Danger
hazard classes and categories	Acute Tox. 4 (98.99%) Acute Tox. 4 (22.3%) Skin Irrit. 2 (100%) Eye Dam. 1 (99.32%) STOT SE 3 (58.11%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (98.99%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (22.3%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (99.32%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (58.11%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
hazards summary	Causes somnolence, necrotic gastrointestinal changes, and diffuse hepatitis in oral lethal-dose studies of rats. An irritant that may cause serious eye injury. Toxic by ingestion and skin absorption. See Acid Anhydrides.

Product No: AZ3503

oxane-2,6-dione, 95%

Product No: AZ3503

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

Reviews

Product No: AZ3503

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?