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90390-84-4 | 2H-Benzo[a]quinolizine, 1,3,4,6,7,11b-hexahydro-7-phenyl-, trans-
CAS No: 90390-84-4 Catalog No: AG006QMY MDL No:
Product Description
Catalog Number:
AG006QMY
Chemical Name:
2H-Benzo[a]quinolizine, 1,3,4,6,7,11b-hexahydro-7-phenyl-, trans-
CAS Number:
90390-84-4
Molecular Formula:
C19H21N
Molecular Weight:
263.3767
IUPAC Name:
(7R,11bS)-7-phenyl-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizine
InChI:
InChI=1S/C19H21N/c1-2-8-15(9-3-1)18-14-20-13-7-6-12-19(20)17-11-5-4-10-16(17)18/h1-5,8-11,18-19H,6-7,12-14H2/t18-,19+/m1/s1
InChI Key:
RDHQAERKGRHFCB-MOPGFXCFSA-N
SMILES:
c1ccc(cc1)[C@H]1CN2CCCC[C@H]2c2c1cccc2
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
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:
1
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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