2-(Hydroxymethyl)-5-methylbenzimidazole - CAS 20034-02-0

Catalog:	BB015468
Product Name:	2-(Hydroxymethyl)-5-methylbenzimidazole
CAS:	20034-02-0
Synonyms:	(6-methyl-1H-benzimidazol-2-yl)methanol; (6-methyl-1H-benzimidazol-2-yl)methanol

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Computed Properties

IUPAC Name:	(6-methyl-1H-benzimidazol-2-yl)methanol
Description:	2-(Hydroxymethyl)-5-methylbenzimidazole (CAS# 20034-02-0) is a useful research chemical.
Molecular Weight:	162.19
Molecular Formula:	C9H10N2O
Canonical SMILES:	CC1=CC2=C(C=C1)N=C(N2)CO
InChI:	InChI=1S/C9H10N2O/c1-6-2-3-7-8(4-6)11-9(5-12)10-7/h2-4,12H,5H2,1H3,(H,10,11)
InChI Key:	GUVUEQHXSSOYNR-UHFFFAOYSA-N
Boiling Point:	416.3 °C at 760 mmHg
Density:	1.295 g/cm³
MDL:	MFCD01874328
LogP:	1.36360

Publication Number	Title	Priority Date
US-10577349-B2	Quinolinones as inhibitors of translation initiation complex	20150302
US-2018044324-A1	Quinolinones as Inhibitors of Translation Initiation Complex	20150302
WO-2016140973-A1	Quinolinones as inhibitors of translation initiation complex	20150302
EP-2951168-B1	Quinoline and quinoxaline amides as modulators of sodium channels	20130131
US-2014228371-A1	Quinoline and quinazoline amides as modulators of sodium channels	20130131

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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:	163
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	162.079312947
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	162.079312947
Rotatable Bond Count:	1
Topological Polar Surface Area:	48.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1