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113505-07-0 | Benzenamine, 4,4'-(3,4-dihydro-1(2H)-naphthalenylidene)bis- (9CI)
CAS No: 113505-07-0 Catalog No: AG0008TL MDL No:
Product Description
Catalog Number:
AG0008TL
Chemical Name:
Benzenamine, 4,4'-(3,4-dihydro-1(2H)-naphthalenylidene)bis- (9CI)
CAS Number:
113505-07-0
Molecular Formula:
C22H22N2
Molecular Weight:
314.4235
IUPAC Name:
4-[1-(4-aminophenyl)-3,4-dihydro-2H-naphthalen-1-yl]aniline
InChI:
InChI=1S/C22H22N2/c23-19-11-7-17(8-12-19)22(18-9-13-20(24)14-10-18)15-3-5-16-4-1-2-6-21(16)22/h1-2,4,6-14H,3,5,15,23-24H2
InChI Key:
YPJLCHMNNXBJRQ-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)C1(CCCc2c1cccc2)c1ccc(cc1)N
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.178g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
314.432g/mol
Monoisotopic Mass:
314.178g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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