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79461-72-6 | Quinoline, 1,2,3,4-tetrahydro-1,3-dimethyl-2-phenyl-
CAS No: 79461-72-6 Catalog No: AG005JLJ MDL No:
Product Description
Catalog Number:
AG005JLJ
Chemical Name:
Quinoline, 1,2,3,4-tetrahydro-1,3-dimethyl-2-phenyl-
CAS Number:
79461-72-6
Molecular Formula:
C17H19N
Molecular Weight:
237.3395
IUPAC Name:
1,3-dimethyl-2-phenyl-3,4-dihydro-2H-quinoline
InChI:
InChI=1S/C17H19N/c1-13-12-15-10-6-7-11-16(15)18(2)17(13)14-8-4-3-5-9-14/h3-11,13,17H,12H2,1-2H3
InChI Key:
KRQFKVBTWFEENB-UHFFFAOYSA-N
SMILES:
CC1Cc2ccccc2N(C1c1ccccc1)C
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.152g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.346g/mol
Monoisotopic Mass:
237.152g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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