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116436-11-4 | Acetamide, N-(2-bromo-6-methylphenyl)-
CAS No: 116436-11-4 Catalog No: AG000CHS MDL No:
Product Description
Catalog Number:
AG000CHS
Chemical Name:
Acetamide, N-(2-bromo-6-methylphenyl)-
CAS Number:
116436-11-4
Molecular Formula:
C9H10BrNO
Molecular Weight:
228.0858
IUPAC Name:
N-(2-bromo-6-methylphenyl)acetamide
InChI:
InChI=1S/C9H10BrNO/c1-6-4-3-5-8(10)9(6)11-7(2)12/h3-5H,1-2H3,(H,11,12)
InChI Key:
VXIIBTQSQWEMHV-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1c(C)cccc1Br
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.995g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
228.089g/mol
Monoisotopic Mass:
226.995g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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