AG00388D

17100-64-0 | 2-Bromo-5-hydroxymethyl-anisole

AG00388D

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CAS Number	17100-64-0
Catalog Number	AG00388D(AGN-PC-00N0TU)
Chemical Name	2-Bromo-5-hydroxymethyl-anisole
IUPAC Name	(4-bromo-3-methoxyphenyl)methanol
InChI	InChI=1S/C8H9BrO2/c1-11-8-4-6(5-10)2-3-7(8)9/h2-4,10H,5H2,1H3
InChI Key	KXUYHKRDJBTPDF-UHFFFAOYSA-N
MDL Number	MFCD11053671
Molecular Formula	C8H9BrO2
Molecular Weight	217.0599
SMILES	BrC1=C(C=C(C=C1)CO)OC
Synonyms	(4-bromo-3-methoxyphenyl)methanol, 17100-64-0, 2-BROMO-5-HYDROXYMETHYL-ANISOLE, 4-bromo-3-methoxybenzyl alcohol, 2-Bromo-5-hydroxymethylanisole, Benzenemethanol, 4-bromo-3-methoxy-, AK-33662, Benzenemethanol,4-bromo-3-methoxy-, SCHEMBL2295220, 4-Bromo-3-methoxybenzenemethanol, CTK4D3788, DTXSID60543584, KXUYHKRDJBTPDF-UHFFFAOYSA-N, ACT09102, KS-00000MW8, (4-bromo-3-methoxyphenyl) methanol, (4-Bromo-3-methoxyphenyl)-methanol, Benzyl alcohol, 4-bromo-3-methoxy-, MFCD11053671, ZINC40448303, AKOS015909288, AM82869, CS-W009160, DS-3012, FCH1402183, QC-8441, RP27046, ACM17100640, CJ-20112, OR400176, SC-89021, AB0005419, AJ-102618, AX8071958, ST2414326, 4CH-015042, FT-0647570, Z0261, Q-8128, J-508383, I14-33774, C8H9BrO2, ACN-050595, (4-((benzyloxy)methyl)phenyl)methanamine,

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	1
Isotope Atom Count	0
Molecular Weight	217.062g/mol
Monoisotopic Mass	215.979g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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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