AG007U99

171011-37-3 | 4-Bromo-2-(hydroxymethyl)benzyl alcohol

AG007U99

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CAS Number	171011-37-3
Catalog Number	AG007U99(AGN-PC-0NAR44)
Chemical Name	4-Bromo-2-(hydroxymethyl)benzyl alcohol
IUPAC Name	[4-bromo-2-(hydroxymethyl)phenyl]methanol
InChI	InChI=1S/C8H9BrO2/c9-8-2-1-6(4-10)7(3-8)5-11/h1-3,10-11H,4-5H2
InChI Key	GFQKHXCSNFITHX-UHFFFAOYSA-N
MDL Number	MFCD15147229
Molecular Formula	C8H9BrO2
Molecular Weight	217.0599
SMILES	BrC1=CC=C(CO)C(CO)=C1
Synonyms	(4-bromo-1,2-phenylene)dimethanol, 171011-37-3, [5-bromo-2-(hydroxymethyl)phenyl]methanol, 1,2-Benzenedimethanol, 4-bromo-, SCHEMBL795719, 4-bromobenzene-1,2-dimethanol, CTK0E4740, DTXSID00445053, GFQKHXCSNFITHX-UHFFFAOYSA-N, MFCD15147229, ZINC34482129, 4-bromo-2-hydroxymethylbenzyl alcohol, AKOS025395560, MCULE-6588721762, NE37877, 4-Bromo-2-(hydroxymethyl)benzyl alcohol, AK173578, AM803322, SY103444, CS-0037994, MFCD15147229 (95%), Z1863617791, CID10798791,

Complexity	119
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.979g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	217.062g/mol
Monoisotopic Mass	215.979g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	40.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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