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20331-18-4 | Propanamide, N-(4-butylphenyl)-3-chloro-
CAS No: 20331-18-4 Catalog No: AG0028TN MDL No:MFCD02973803
Product Description
Catalog Number:
AG0028TN
Chemical Name:
Propanamide, N-(4-butylphenyl)-3-chloro-
CAS Number:
20331-18-4
Molecular Formula:
C13H18ClNO
Molecular Weight:
239.7411
MDL Number:
MFCD02973803
IUPAC Name:
N-(4-butylphenyl)-3-chloropropanamide
InChI:
InChI=1S/C13H18ClNO/c1-2-3-4-11-5-7-12(8-6-11)15-13(16)9-10-14/h5-8H,2-4,9-10H2,1H3,(H,15,16)
InChI Key:
INOJDKOCKGZNQW-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)NC(=O)CCCl
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.108g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.743g/mol
Monoisotopic Mass:
239.108g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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