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116436-10-3 | Acetamide, N-(5-bromo-2-methylphenyl)-
CAS No: 116436-10-3 Catalog No: AG000CHT MDL No:MFCD11520466
Product Description
Catalog Number:
AG000CHT
Chemical Name:
Acetamide, N-(5-bromo-2-methylphenyl)-
CAS Number:
116436-10-3
Molecular Formula:
C9H10BrNO
Molecular Weight:
228.0858
MDL Number:
MFCD11520466
IUPAC Name:
N-(5-bromo-2-methylphenyl)acetamide
InChI:
InChI=1S/C9H10BrNO/c1-6-3-4-8(10)5-9(6)11-7(2)12/h3-5H,1-2H3,(H,11,12)
InChI Key:
HCSKOFDCUTVQKW-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1NC(=O)C)Br
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:
1.9
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