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693224-77-0 | Benzenamine, 4,4'-(9-anthracenylmethylene)bis[2,6-dimethyl-
CAS No: 693224-77-0 Catalog No: AG006GEO MDL No:
Product Description
Catalog Number:
AG006GEO
Chemical Name:
Benzenamine, 4,4'-(9-anthracenylmethylene)bis[2,6-dimethyl-
CAS Number:
693224-77-0
Molecular Formula:
C31H30N2
Molecular Weight:
430.5833
IUPAC Name:
4-[(4-amino-3,5-dimethylphenyl)-anthracen-9-ylmethyl]-2,6-dimethylaniline
InChI:
InChI=1S/C31H30N2/c1-18-13-24(14-19(2)30(18)32)28(25-15-20(3)31(33)21(4)16-25)29-26-11-7-5-9-22(26)17-23-10-6-8-12-27(23)29/h5-17,28H,32-33H2,1-4H3
InChI Key:
RHPVCPLJLVJUKU-UHFFFAOYSA-N
SMILES:
Nc1c(C)cc(cc1C)C(c1c2ccccc2cc2c1cccc2)c1cc(C)c(c(c1)C)N
Properties
Complexity:
571
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
430.241g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
430.595g/mol
Monoisotopic Mass:
430.241g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.9
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