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Product No: BD8050

(3S)-oxan-3-amine hydrochloride, 95%

Name: (3S)-oxan-3-amine hydrochloride
Brand: Chempure

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CAS Number

1245724-46-2

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About this item

IUPAC name	(3S)-oxan-3-amine;hydrochloride
canonical smiles	C1CC(COC1)N.Cl
inchi	InChI=1S/C5H11NO.ClH/c6-5-2-1-3-7-4-5;/h5H,1-4,6H2;1H/t5-;/m0./s1
inchi key	RETPVBQTPDYSBS-JEDNCBNOSA-N
molecular formula	C5H12ClNO
synonyms	1245724-46-2 (S)-tetrahydro-2H-pyran-3-amine hydrochloride (S)-3-Aminotetrahydropyran Hydrochloride (3S)-oxan-3-amine hydrochloride (3S)-oxan-3-amine;hydrochloride

Computed Properties

Molecular Weight:	137.61 g/mol
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	0
Exact Mass:	137.0607417 g/mol
Monoisotopic Mass:	137.0607417 g/mol
Topological Polar Surface Area:	35.2 Å²
Heavy Atom Count:	8
Formal Charge:	0
Complexity:	56
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:	2
Compound Is Canonicalized:	Yes

Related Compounds

tetrahydro-2H-pyran-3-amine

Tetrahydro-2H-pyran-3-amine hydrochloride

4,4-Ifluoro-etrahydropyran-3-lamine hydrochloride

(S)-tetrahydro-2H-pyran-3-amine hydrochloride

(R)-tetrahydro-2H-pyran-3-amine hydrochloride

5,5-Difluorotetrahydropyran-3-amine;hydrochloride

5-Fluorotetrahydro-2H-pyran-3-amine

(S)-tetrahydro-2H-pyran-3-amine

[(3S)-oxan-3-yl]azanide

2-Iodooxan-3-amine;hydrochloride

(3R,4R)-4-fluorotetrahydropyran-3-amine;hydrochloride

Oxan-3-ylazanium

cis-Tetrahydropyran-3,5-diamine

[(3R)-oxan-3-yl]azanide

N-iodooxan-3-amine

hazard signal	Danger
hazard classes and categories	Acute Tox. 4 (100%) Skin Irrit. 2 (100%) Eye Dam. 1 (100%) STOT SE 3 (100%)
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 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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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	(3S)-oxan-3-amine;hydrochloride
canonical smiles	C1CC(COC1)N.Cl
inchi	InChI=1S/C5H11NO.ClH/c6-5-2-1-3-7-4-5;/h5H,1-4,6H2;1H/t5-;/m0./s1
inchi key	RETPVBQTPDYSBS-JEDNCBNOSA-N
molecular formula	C5H12ClNO
synonyms	1245724-46-2 (S)-tetrahydro-2H-pyran-3-amine hydrochloride (S)-3-Aminotetrahydropyran Hydrochloride (3S)-oxan-3-amine hydrochloride (3S)-oxan-3-amine;hydrochloride

Computed Properties

Molecular Weight:	137.61 g/mol
Hydrogen Bond Donor Count:	2
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	0
Exact Mass:	137.0607417 g/mol
Monoisotopic Mass:	137.0607417 g/mol
Topological Polar Surface Area:	35.2 Å²
Heavy Atom Count:	8
Formal Charge:	0
Complexity:	56
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:	2
Compound Is Canonicalized:	Yes

Related Compounds

tetrahydro-2H-pyran-3-amine

Tetrahydro-2H-pyran-3-amine hydrochloride

4,4-Ifluoro-etrahydropyran-3-lamine hydrochloride

(S)-tetrahydro-2H-pyran-3-amine hydrochloride

(R)-tetrahydro-2H-pyran-3-amine hydrochloride

5,5-Difluorotetrahydropyran-3-amine;hydrochloride

5-Fluorotetrahydro-2H-pyran-3-amine

(S)-tetrahydro-2H-pyran-3-amine

[(3S)-oxan-3-yl]azanide

2-Iodooxan-3-amine;hydrochloride

(3R,4R)-4-fluorotetrahydropyran-3-amine;hydrochloride

Oxan-3-ylazanium

cis-Tetrahydropyran-3,5-diamine

[(3R)-oxan-3-yl]azanide

N-iodooxan-3-amine

hazard signal	Danger
hazard classes and categories	Acute Tox. 4 (100%) Skin Irrit. 2 (100%) Eye Dam. 1 (100%) STOT SE 3 (100%)
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 (100%): Harmful if swallowed [Warning Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Product No: BD8050

(3S)-oxan-3-amine hydrochloride, 95%

Product No: BD8050

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: BD8050

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?