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126759-48-6 | Acetamide, N-(2-bromo-5-methylphenyl)-
CAS No: 126759-48-6 Catalog No: AG000T71 MDL No:
Product Description
Catalog Number:
AG000T71
Chemical Name:
Acetamide, N-(2-bromo-5-methylphenyl)-
CAS Number:
126759-48-6
Molecular Formula:
C9H10BrNO
Molecular Weight:
228.0858
IUPAC Name:
N-(2-bromo-5-methylphenyl)acetamide
InChI:
InChI=1S/C9H10BrNO/c1-6-3-4-8(10)9(5-6)11-7(2)12/h3-5H,1-2H3,(H,11,12)
InChI Key:
SRJOJXJRVGYFMM-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(C)ccc1Br
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:
1.8
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