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88062-13-9 | Quinoline, 3,4-dihydro-2-(phenylmethyl)-
CAS No: 88062-13-9 Catalog No: AG004IE8 MDL No:
Product Description
Catalog Number:
AG004IE8
Chemical Name:
Quinoline, 3,4-dihydro-2-(phenylmethyl)-
CAS Number:
88062-13-9
Molecular Formula:
C16H15N
Molecular Weight:
221.2970
IUPAC Name:
2-benzyl-3,4-dihydroquinoline
InChI:
InChI=1S/C16H15N/c1-2-6-13(7-3-1)12-15-11-10-14-8-4-5-9-16(14)17-15/h1-9H,10-12H2
InChI Key:
ZAUUKUMRQCZOSM-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CC1=Nc2c(CC1)cccc2
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.12g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.303g/mol
Monoisotopic Mass:
221.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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