AG0096LW

103286-27-7 | 1-(2-Bromo-4-methylphenyl)ethanone

AG0096LW

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CAS Number	103286-27-7
Catalog Number	AG0096LW(AGN-PC-0061LT)
Chemical Name	1-(2-Bromo-4-methylphenyl)ethanone
IUPAC Name	1-(2-bromo-4-methylphenyl)ethanone
InChI	InChI=1S/C9H9BrO/c1-6-3-4-8(7(2)11)9(10)5-6/h3-5H,1-2H3
InChI Key	WQUTYGRAHPHFBE-UHFFFAOYSA-N
MDL Number	MFCD08061386
Molecular Formula	C9H9BrO
Molecular Weight	213.0712
SMILES	CC(C1=CC=C(C)C=C1Br)=O
Synonyms	1-(2-BROMO-4-METHYLPHENYL)ETHANONE, 103286-27-7, Ethanone, 1-(2-bromo-4-methylphenyl)-, ACMC-20m65n, SCHEMBL1329346, 2'-bromo-4'-methylacetophenone, CTK0G7130, DTXSID50461243, MFCD08061386, ZINC49815272, AKOS017558419, 1-(2-Bromo-4-methyl-phenyl)-ethanone, 1-(2-bromo-4-methylphenyl)ethan-1-one, AM806696, AS-40725, SC-36117, AJ-111455, ST2401724, A1-05209, 1-(2-bromo-4-methyl-phenyl)ethanone, ACN-052340, CID11287326,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	211.984g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	213.074g/mol
Monoisotopic Mass	211.984g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	17.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P261-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number