(S)-5-(Hydroxymethyl)oxazolidin-2-one - CAS 97859-51-3

Catalog:	BB042075
Product Name:	(S)-5-(Hydroxymethyl)oxazolidin-2-one
CAS:	97859-51-3
Synonyms:	(5S)-5-(hydroxymethyl)-2-oxazolidinone; (5S)-5-(hydroxymethyl)-1,3-oxazolidin-2-one

Technical Data

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Computed Properties

IUPAC Name:	(5S)-5-(hydroxymethyl)-1,3-oxazolidin-2-one
Description:	(S)-5-(Hydroxymethyl)oxazolidin-2-one (CAS# 97859-51-3) is a useful research chemical.
Molecular Weight:	117.10
Molecular Formula:	C4H7NO3
Canonical SMILES:	C1C(OC(=O)N1)CO
InChI:	InChI=1S/C4H7NO3/c6-2-3-1-5-4(7)8-3/h3,6H,1-2H2,(H,5,7)/t3-/m0/s1
InChI Key:	LSYOFPBORRARMF-VKHMYHEASA-N
Storage:	Keep in dark place, Inert atmosphere, Room temperature
LogP:	-0.58410

Publication Number	Title	Priority Date
WO-2019186590-A1	Oxazolidinone antibiotic compounds and process of preparation	20180328
CN-112218862-A	Oxazolidinone antibiotic compounds and process for their preparation	20180328
EP-3774790-A1	Oxazolidinone antibiotic compounds and process of preparation	20180328
US-2021008078-A1	Oxazolidinone antibiotic compounds and process of preparation	20180328
JP-2021519314-A	Oxazolidinone antibiotic compound and preparation method	20180328

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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:	104
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	117.042593085
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	117.042593085
Rotatable Bond Count:	1
Topological Polar Surface Area:	58.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.9