AG002U33

27561-51-9 | Benzene, 1-bromo-4-(bromomethyl)-2-methyl-

AG002U33

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CAS Number	27561-51-9
Catalog Number	AG002U33(AGN-PC-00H2QD)
Chemical Name	Benzene, 1-bromo-4-(bromomethyl)-2-methyl-
IUPAC Name	1-bromo-4-(bromomethyl)-2-methylbenzene
InChI	InChI=1S/C8H8Br2/c1-6-4-7(5-9)2-3-8(6)10/h2-4H,5H2,1H3
InChI Key	CWOKZNRRLJXSAA-UHFFFAOYSA-N
MDL Number	MFCD09909629
Molecular Formula	C8H8Br2
Molecular Weight	263.9571
SMILES	CC1=C(Br)C=CC(CBr)=C1
Synonyms	1-Bromo-4-(bromomethyl)-2-methylbenzene, 27561-51-9, Benzene, 1-bromo-4-(bromomethyl)-2-methyl-, 4-BROMO-3-METHYLBENZYL BROMIDE, PubChem24290, SCHEMBL308275, CTK4F9872, KS-00000HWS, DTXSID10474177, CWOKZNRRLJXSAA-UHFFFAOYSA-N, ANW-57068, MFCD09909629, ZINC64034005, AKOS015151139, CS-W021310, AK-77564, AS-46296, BC005026, SC-49877, AJ-114711, DB-010023, TC-145813, FT-0750541, ST24027054, CID11832265, 1-bromo-4-(bromomethyl)-2-methyl-benzene,

Complexity	103
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	263.897g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	263.96g/mol
Monoisotopic Mass	261.899g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	0A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338-P310
UN Code	UN 1760

Certificate of Analysis

Lot Number