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88638-03-3 | 1,2-Ethanediamine, N-ethyl-N'-(4-methoxyphenyl)-N-phenyl-
CAS No: 88638-03-3 Catalog No: AG0049EE MDL No:
Product Description
Catalog Number:
AG0049EE
Chemical Name:
1,2-Ethanediamine, N-ethyl-N'-(4-methoxyphenyl)-N-phenyl-
CAS Number:
88638-03-3
Molecular Formula:
C17H22N2O
Molecular Weight:
270.3694
IUPAC Name:
N'-ethyl-N-(4-methoxyphenyl)-N'-phenylethane-1,2-diamine
InChI:
InChI=1S/C17H22N2O/c1-3-19(16-7-5-4-6-8-16)14-13-18-15-9-11-17(20-2)12-10-15/h4-12,18H,3,13-14H2,1-2H3
InChI Key:
MCFKTVCNXJBUMC-UHFFFAOYSA-N
SMILES:
CCN(c1ccccc1)CCNc1ccc(cc1)OC
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.173g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
270.376g/mol
Monoisotopic Mass:
270.173g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
24.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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