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113505-06-9 | Benzenamine, 4,4'-(2,3-dihydro-1H-inden-1-ylidene)bis-
CAS No: 113505-06-9 Catalog No: AG0008TM MDL No:
Product Description
Catalog Number:
AG0008TM
Chemical Name:
Benzenamine, 4,4'-(2,3-dihydro-1H-inden-1-ylidene)bis-
CAS Number:
113505-06-9
Molecular Formula:
C21H20N2
Molecular Weight:
300.3969
IUPAC Name:
4-[1-(4-aminophenyl)-2,3-dihydroinden-1-yl]aniline
InChI:
InChI=1S/C21H20N2/c22-18-9-5-16(6-10-18)21(17-7-11-19(23)12-8-17)14-13-15-3-1-2-4-20(15)21/h1-12H,13-14,22-23H2
InChI Key:
XZCQAIZKUGZJDW-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)C1(CCc2c1cccc2)c1ccc(cc1)N
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.163g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
300.405g/mol
Monoisotopic Mass:
300.163g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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