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798-68-5 | N,N,2,3-TETRAMETHYL-4-(2-(QUINOLIN-4-YL)VINYL)ANILINE
CAS No: 798-68-5 Catalog No: AG004ZEO MDL No:
Product Description
Catalog Number:
AG004ZEO
Chemical Name:
N,N,2,3-TETRAMETHYL-4-(2-(QUINOLIN-4-YL)VINYL)ANILINE
CAS Number:
798-68-5
Molecular Formula:
C21H22N2
Molecular Weight:
302.4128
IUPAC Name:
N,N,2,3-tetramethyl-4-(2-quinolin-4-ylethenyl)aniline
InChI:
InChI=1S/C21H22N2/c1-15-16(2)21(23(3)4)12-11-17(15)9-10-18-13-14-22-20-8-6-5-7-19(18)20/h5-14H,1-4H3
InChI Key:
BOHNKFWQJRVQCE-UHFFFAOYSA-N
SMILES:
Cc1c(C=Cc2ccnc3c2cccc3)ccc(c1C)N(C)C
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.178g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.421g/mol
Monoisotopic Mass:
302.178g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
16.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.3
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