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136800-94-7 | Quinoline, 3-pentyl-2-phenyl-
CAS No: 136800-94-7 Catalog No: AG007ZYT MDL No:
Product Description
Catalog Number:
AG007ZYT
Chemical Name:
Quinoline, 3-pentyl-2-phenyl-
CAS Number:
136800-94-7
Molecular Formula:
C20H21N
Molecular Weight:
275.3874
IUPAC Name:
3-pentyl-2-phenylquinoline
InChI:
InChI=1S/C20H21N/c1-2-3-5-13-18-15-17-12-8-9-14-19(17)21-20(18)16-10-6-4-7-11-16/h4,6-12,14-15H,2-3,5,13H2,1H3
InChI Key:
FNLZZWRVNJRQET-UHFFFAOYSA-N
SMILES:
CCCCCc1cc2ccccc2nc1c1ccccc1
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.167g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.395g/mol
Monoisotopic Mass:
275.167g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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