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179923-27-4 | Benzenebutanamide, N-(phenylmethyl)-
CAS No: 179923-27-4 Catalog No: AG0027D6 MDL No:
Product Description
Catalog Number:
AG0027D6
Chemical Name:
Benzenebutanamide, N-(phenylmethyl)-
CAS Number:
179923-27-4
Molecular Formula:
C17H19NO
Molecular Weight:
253.3389
IUPAC Name:
N-benzyl-4-phenylbutanamide
InChI:
InChI=1S/C17H19NO/c19-17(18-14-16-10-5-2-6-11-16)13-7-12-15-8-3-1-4-9-15/h1-6,8-11H,7,12-14H2,(H,18,19)
InChI Key:
KEJVNASKYBEZQN-UHFFFAOYSA-N
SMILES:
O=C(NCc1ccccc1)CCCc1ccccc1
Properties
Complexity:
252
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:
6
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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