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148717-48-0 | Benzenepropanamine, N-(1-phenylethyl)-
CAS No: 148717-48-0 Catalog No: AG001L58 MDL No:
Product Description
Catalog Number:
AG001L58
Chemical Name:
Benzenepropanamine, N-(1-phenylethyl)-
CAS Number:
148717-48-0
Molecular Formula:
C17H21N
Molecular Weight:
239.3553
IUPAC Name:
3-phenyl-N-(1-phenylethyl)propan-1-amine
InChI:
InChI=1S/C17H21N/c1-15(17-12-6-3-7-13-17)18-14-8-11-16-9-4-2-5-10-16/h2-7,9-10,12-13,15,18H,8,11,14H2,1H3
InChI Key:
RNMIIZKBSKGZEE-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1)NCCCc1ccccc1
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.167g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
239.362g/mol
Monoisotopic Mass:
239.167g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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