oxazole-5-methanol - CAS 127232-41-1

Name: oxazole-5-methanol
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB006748
Product Name:	oxazole-5-methanol
CAS:	127232-41-1
Synonyms:	5-oxazolylmethanol; 1,3-oxazol-5-ylmethanol

Technical Data

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Computed Properties

IUPAC Name:	1,3-oxazol-5-ylmethanol
Description:	oxazole-5-methanol (CAS# 127232-41-1) is a useful research chemical.
Molecular Weight:	99.09
Molecular Formula:	C4H5NO2
Canonical SMILES:	C1=C(OC=N1)CO
InChI:	InChI=1S/C4H5NO2/c6-2-4-1-5-3-7-4/h1,3,6H,2H2
InChI Key:	CRPXMLXYMBLZEP-UHFFFAOYSA-N
Boiling Point:	212.8 °C at 760 mmHg
Purity:	95 %
Density:	1.25 g/cm³
Appearance:	Yellow to brown liquid
MDL:	MFCD09027272
LogP:	0.16690

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GHS Hazard Statement:	H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Publication Number	Title	Priority Date
WO-2021083380-A1	Eed inhibitor, and preparation method therefor and use thereof	20191101
WO-2020085234-A1	Morphinan derivative	20181022
US-11077101-B1	Compounds and methods of use	20180718
JP-2021521176-A	Pradienolide derivatives as spliceosome targeting agents for cancer treatment	20180412
AU-2018388404-A1	Aminopyridine derivatives as phosphatidylinositol phosphate kinase inhibitors	20171222

Complexity:	57.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	99.032028402
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	99.032028402
Rotatable Bond Count:	1
Topological Polar Surface Area:	46.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.5