AG001DB1

145691-59-4 | Benzenemethanol, 3,5-dibromo-

AG001DB1

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CAS Number	145691-59-4
Catalog Number	AG001DB1(AGN-PC-0LW55U)
Chemical Name	Benzenemethanol, 3,5-dibromo-
IUPAC Name	(3,5-dibromophenyl)methanol
InChI	InChI=1S/C7H6Br2O/c8-6-1-5(4-10)2-7(9)3-6/h1-3,10H,4H2
InChI Key	ZQNSHKZQTZSNTB-UHFFFAOYSA-N
MDL Number	MFCD01632143
Molecular Formula	C7H6Br2O
Molecular Weight	265.9299
SMILES	OCC1=CC(Br)=CC(Br)=C1
Synonyms	3,5-Dibromobenzyl alcohol, 145691-59-4, (3,5-Dibromophenyl)Methanol, 3,5-Dibromobenzylalcohol, Benzenemethanol, 3,5-dibromo-, (3,5-dibromophenyl)methan-1-ol, ACMC-20andh, PubChem3864, AC1Q7BZ0, 3,5-dibromo-benzyl alcohol, Benzenemethanol,3,5-dibromo-, SCHEMBL112048, RARECHEM AL BD 0770, (3,5-Dibromo-phenyl)-methanol, CTK4C4652, KS-00000LFT, DTXSID10426555, ZQNSHKZQTZSNTB-UHFFFAOYSA-N, 1,3-Dibromo-5-hydroxymethylbenzene, ACT13300, ZINC2382619, CK1125, MFCD01632143, SBB064628, AKOS005257972, AS03973, CS-W006384, DS-6116, MCULE-7202279820, VZ25706, AC-26183, AJ-34881, AK113197, BC002646, SY101056, AB0034051, DB-042797, RT-008219, 4CH-022072, FT-0614512, ST24034211, ST50408619, X8143, MFCD01632143 (97%), A22378, Q-8985, I01-5283, C7H6Br2O, ZINC02382619, CID7009423,

Complexity	97.8
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.876g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	265.932g/mol
Monoisotopic Mass	263.879g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

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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