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22920-59-8 | Benzenemethanamine, α-ethyl-N-phenyl-
CAS No: 22920-59-8 Catalog No: AG002LIO MDL No:
Product Description
Catalog Number:
AG002LIO
Chemical Name:
Benzenemethanamine, α-ethyl-N-phenyl-
CAS Number:
22920-59-8
Molecular Formula:
C15H17N
Molecular Weight:
211.3022
IUPAC Name:
N-(1-phenylpropyl)aniline
InChI:
InChI=1S/C15H17N/c1-2-15(13-9-5-3-6-10-13)16-14-11-7-4-8-12-14/h3-12,15-16H,2H2,1H3
InChI Key:
KYJKITQCBFVYDT-UHFFFAOYSA-N
SMILES:
CCC(c1ccccc1)Nc1ccccc1
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.136g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.308g/mol
Monoisotopic Mass:
211.136g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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