3-Amino-2-oxazolidinone - CAS 80-65-9

Catalog:	BB046771
Product Name:	3-Amino-2-oxazolidinone
CAS:	80-65-9
Synonyms:	3-Aminooxazolidin-2-one; 3-Amino-2-oxazolidone; 2-Oxazolidinone, 3-amino-; AOZ; NSC 111187; NSC 196570; NSC 38250

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	3-amino-1,3-oxazolidin-2-one
Description:	A metabolite of Furazolidone and Nitrofuran.
Molecular Weight:	102.09
Molecular Formula:	C3H6N2O2
Canonical SMILES:	C1COC(=O)N1N
InChI:	InChI=1S/C3H6N2O2/c4-5-1-2-7-3(5)6/h1-2,4H2
InChI Key:	KYCJNIUHWNJNCT-UHFFFAOYSA-N
Boiling Point:	167.2 °C at 760 mmHg
Melting Point:	59-62 °C
Purity:	95%
Density:	1.363 g/cm³
Solubility:	Soluble in Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
Appearance:	White to off-white solid

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Related Functional Groups

Amines and Anilines

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Pseudothiohydantoin
[1232060-85-3]
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1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[253429-30-0]
1-Bromo-2-(2,2-diethoxyethoxy)-4-fluorobenzene
[865774-78-3]
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

Oxazolines/Oxazolidines

[22876-17-1]
6-Amino-2-benzoxazolinone
[2923-94-6]
6-Fluoro-2(3H)-benzoxazolone
[25664-78-2]
5-Ethyl-2-oxazolidinone
[7127-19-7]
2-Phenyl-2-oxazoline
[1172266-75-9]
3-(1,3,5-Trimethyl-1H-pyrazol-4-yl)isoxazol-5-amine
[1018144-20-1]
Methyl 3-(4-methoxyphenyl)-6-methylisoxazolo[5,4-b]pyridine-4-carboxylate

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	92.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	102.042927438
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	102.042927438
Rotatable Bond Count:	0
Topological Polar Surface Area:	55.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.8