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191677-12-0 | Hexanamide, N-[(1R)-1-phenylethyl]-
CAS No: 191677-12-0 Catalog No: AG002FES MDL No:
Product Description
Catalog Number:
AG002FES
Chemical Name:
Hexanamide, N-[(1R)-1-phenylethyl]-
CAS Number:
191677-12-0
Molecular Formula:
C14H21NO
Molecular Weight:
219.3226
IUPAC Name:
N-[(1R)-1-phenylethyl]hexanamide
InChI:
InChI=1S/C14H21NO/c1-3-4-6-11-14(16)15-12(2)13-9-7-5-8-10-13/h5,7-10,12H,3-4,6,11H2,1-2H3,(H,15,16)/t12-/m1/s1
InChI Key:
DGNYVUGHUGTLTE-GFCCVEGCSA-N
SMILES:
CCCCCC(=O)N[C@@H](c1ccccc1)C
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
219.162g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.328g/mol
Monoisotopic Mass:
219.162g/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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