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101602-51-1 | Benzenemethanamine, 2-[2-(dimethylamino)ethoxy]-N-phenyl-
CAS No: 101602-51-1 Catalog No: AG0004YP MDL No:
Product Description
Catalog Number:
AG0004YP
Chemical Name:
Benzenemethanamine, 2-[2-(dimethylamino)ethoxy]-N-phenyl-
CAS Number:
101602-51-1
Molecular Formula:
C17H22N2O
Molecular Weight:
270.3694
IUPAC Name:
N-[[2-[2-(dimethylamino)ethoxy]phenyl]methyl]aniline
InChI:
InChI=1S/C17H22N2O/c1-19(2)12-13-20-17-11-7-6-8-15(17)14-18-16-9-4-3-5-10-16/h3-11,18H,12-14H2,1-2H3
InChI Key:
VYFSGDIOYSIFDW-UHFFFAOYSA-N
SMILES:
CN(CCOc1ccccc1CNc1ccccc1)C
Properties
Complexity:
251
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:
3.4
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