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149539-11-7 | Octanamide, N-[(1R)-1-phenylethyl]-
CAS No: 149539-11-7 Catalog No: AG001LSP MDL No:
Product Description
Catalog Number:
AG001LSP
Chemical Name:
Octanamide, N-[(1R)-1-phenylethyl]-
CAS Number:
149539-11-7
Molecular Formula:
C16H25NO
Molecular Weight:
247.3758
IUPAC Name:
N-(1-phenylethyl)octanamide
InChI:
InChI=1S/C16H25NO/c1-3-4-5-6-10-13-16(18)17-14(2)15-11-8-7-9-12-15/h7-9,11-12,14H,3-6,10,13H2,1-2H3,(H,17,18)
InChI Key:
TWXVFDSCHKROSL-UHFFFAOYSA-N
SMILES:
CCCCCCCC(=O)N[C@@H](c1ccccc1)C
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.194g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.382g/mol
Monoisotopic Mass:
247.194g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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