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887353-43-7 | 1H-Cyclopenta[c]quinoline, 2,3,3a,4,5,9b-hexahydro-5-(phenylmethyl)-
CAS No: 887353-43-7 Catalog No: AG0045IC MDL No:
Product Description
Catalog Number:
AG0045IC
Chemical Name:
1H-Cyclopenta[c]quinoline, 2,3,3a,4,5,9b-hexahydro-5-(phenylmethyl)-
CAS Number:
887353-43-7
Molecular Formula:
C19H21N
Molecular Weight:
263.3767
IUPAC Name:
5-benzyl-1,2,3,3a,4,9b-hexahydrocyclopenta[c]quinoline
InChI:
InChI=1S/C19H21N/c1-2-7-15(8-3-1)13-20-14-16-9-6-11-17(16)18-10-4-5-12-19(18)20/h1-5,7-8,10,12,16-17H,6,9,11,13-14H2
InChI Key:
HINXOYBVOJRZHV-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CN1CC2CCCC2c2c1cccc2
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.167g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.384g/mol
Monoisotopic Mass:
263.167g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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