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125328-80-5 | Acetamide, N-(4-bromo-3-chloro-2-methylphenyl)-
CAS No: 125328-80-5 Catalog No: AG000NIE MDL No:MFCD08059123
Product Description
Catalog Number:
AG000NIE
Chemical Name:
Acetamide, N-(4-bromo-3-chloro-2-methylphenyl)-
CAS Number:
125328-80-5
Molecular Formula:
C9H9BrClNO
Molecular Weight:
262.5309
MDL Number:
MFCD08059123
IUPAC Name:
N-(4-bromo-3-chloro-2-methylphenyl)acetamide
InChI:
InChI=1S/C9H9BrClNO/c1-5-8(12-6(2)13)4-3-7(10)9(5)11/h3-4H,1-2H3,(H,12,13)
InChI Key:
KKYLGFXKQCOIOC-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(c(c1C)Cl)Br
EC Number:
603-055-4
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.956g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.531g/mol
Monoisotopic Mass:
260.956g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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