CAS: 619-41-0
Name: 2-bromo-1-(4-methylphenyl)ethanone
SMILES:
CC1=CC=C(C=C1)C(=O)CBrMolecular Processing
Molecular formula
C9H9BrO
Molecular weight
213.07
Exact mass
211.9837
XLogP
2.57
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
49.3
Supplementary Information
InChIKey: KRVGXFREOJHJAX-UHFFFAOYSA-N
Synonyme
2-Bromo-4'-methylacetophenone619-41-04-Methylphenacyl bromide2-Bromo-1-(4-methylphenyl)ethanoneEthanone, 2-bromo-1-(4-methylphenyl)-EINECS 210-595-0DTXSID40210929NSC 63192RefChem:466363DTXCID20133420210-595-0InChI=1/C9H9BrO/c1-7-2-4-8(5-3-7)9(11)6-10/h2-5H,6H2,1H2-Bromo-1-(p-tolyl)ethanone2-Bromo-1-(4-Methylphenyl)Ethan-1-OneMFCD00000203Acetophenone, 2-bromo-4'-methyl-p-Methylphenacyl bromide4-(Bromoacetyl)toluene2-bromo-1-(p-tolyl)ethan-1-oneNSC-631922-bromo-1-p-tolylethanone2-Bromo-4-Methylacetophenone2-Bromo-1-p-tolyl-ethanone2-Bromo-1-(4-tolyl)ethanoneNSC63192p-methylphenacylbromide7DX9QRY7DPNCIOpen2_0027102-Bromo-p-methylacetophenone2-bromo-4'methylacetophenone
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