4-(Hydroxymethyl)benzamide - CAS 87128-27-6

Catalog:	BB038282
Product Name:	4-(Hydroxymethyl)benzamide
CAS:	87128-27-6
Synonyms:	4-(hydroxymethyl)benzamide; 4-(hydroxymethyl)benzamide

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Computed Properties

IUPAC Name:	4-(hydroxymethyl)benzamide
Description:	4-(Hydroxymethyl)benzamide (CAS# 87128-27-6) is a useful research chemical.
Molecular Weight:	151.16
Molecular Formula:	C8H9NO2
Canonical SMILES:	C1=CC(=CC=C1CO)C(=O)N
InChI:	InChI=1S/C8H9NO2/c9-8(11)7-3-1-6(5-10)2-4-7/h1-4,10H,5H2,(H2,9,11)
InChI Key:	CBNMHHVYVQEPCW-UHFFFAOYSA-N
LogP:	0.97810

Publication Number	Title	Priority Date
WO-2017200984-A1	Novel cyclosporin derivatives and uses thereof	20160517
US-2018155366-A1	Thiazolopyrimidinone compounds and preparation methods and use thereof	20150603
US-10272074-B2	Inhibitors of glucocorticoid receptor translocation	20150129
US-2018207140-A1	Pyrazolopyrimidines as Inhibitors of Glucocorticoid Receptor Translocation	20150129
WO-2016123392-A2	Pyrazolopyrimidines as inhibitors of glucocorticoid receptor translocation	20150129

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	139
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	151.063328530
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	151.063328530
Rotatable Bond Count:	2
Topological Polar Surface Area:	63.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.3