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116368-50-4 | Benzamide, N-(1-phenylbutyl)-
CAS No: 116368-50-4 Catalog No: AG000CAU MDL No:
Product Description
Catalog Number:
AG000CAU
Chemical Name:
Benzamide, N-(1-phenylbutyl)-
CAS Number:
116368-50-4
Molecular Formula:
C17H19NO
Molecular Weight:
253.3389
IUPAC Name:
N-(1-phenylbutyl)benzamide
InChI:
InChI=1S/C17H19NO/c1-2-9-16(14-10-5-3-6-11-14)18-17(19)15-12-7-4-8-13-15/h3-8,10-13,16H,2,9H2,1H3,(H,18,19)
InChI Key:
VZDCIRXTMQWXRT-UHFFFAOYSA-N
SMILES:
CCCC(c1ccccc1)NC(=O)c1ccccc1
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
253.345g/mol
Monoisotopic Mass:
253.147g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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