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31009-92-4 | Butanamide, 2-chloro-N-(2-methoxyphenyl)-3-oxo-
CAS No: 31009-92-4 Catalog No: AG0031X1 MDL No:
Product Description
Catalog Number:
AG0031X1
Chemical Name:
Butanamide, 2-chloro-N-(2-methoxyphenyl)-3-oxo-
CAS Number:
31009-92-4
Molecular Formula:
C11H12ClNO3
Molecular Weight:
241.6709
IUPAC Name:
2-chloro-N-(2-methoxyphenyl)-3-oxobutanamide
InChI:
InChI=1S/C11H12ClNO3/c1-7(14)10(12)11(15)13-8-5-3-4-6-9(8)16-2/h3-6,10H,1-2H3,(H,13,15)
InChI Key:
VUJPCRIPEOTTQO-UHFFFAOYSA-N
SMILES:
COc1ccccc1NC(=O)C(C(=O)C)Cl
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.671g/mol
Monoisotopic Mass:
241.051g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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