AG003KVB

35090-64-3 | 4-Bromo-2-(hydroxymethyl)-6-methoxyphenol

AG003KVB

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CAS Number	35090-64-3
Catalog Number	AG003KVB(AGN-PC-0JXPUG)
Chemical Name	4-Bromo-2-(hydroxymethyl)-6-methoxyphenol
IUPAC Name	4-bromo-2-(hydroxymethyl)-6-methoxyphenol
InChI	InChI=1S/C8H9BrO3/c1-12-7-3-6(9)2-5(4-10)8(7)11/h2-3,10-11H,4H2,1H3
InChI Key	UBLQIISPEAEAIX-UHFFFAOYSA-N
MDL Number	MFCD02081986
Molecular Formula	C8H9BrO3
Molecular Weight	233.0593
SMILES	COC1=C(O)C(CO)=CC(Br)=C1
Synonyms	4-bromo-2-(hydroxymethyl)-6-methoxyphenol, 35090-64-3, 4-Bromo-2-(Hydroxymethyl)-6-Methoxybenzenol, 4-bromo-2-hydroxymethyl-6-methoxyphenol, MFCD02081986, ACMC-20amo4, AC1LHWG3, Bionet2_000506, AC1Q25OB, SCHEMBL293625, AC1Q468O, CTK4H3536, DTXSID60358418, UBLQIISPEAEAIX-UHFFFAOYSA-N, HMS1365G22, ZINC470708, KS-00001S7M, SBB079143, AKOS000338970, MCULE-1473811481, TC-169051, BB 0218632, ST50775466, Benzenemethanol,5-bromo-2-hydroxy-3-methoxy-, 11P-644, 156232-EP2284169A1, 156232-EP2287161A1, 156232-EP2287162A1, I14-92028, AR-1G1168, CID894092, ZINC00470708, 4-BROMO-2- -6-METHOXYBENZENOL, 35288-12-1,

Complexity	142
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	231.974g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	233.061g/mol
Monoisotopic Mass	231.974g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	49.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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