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1745-77-3 | Quinoline, 2-(phenylmethyl)-
CAS No: 1745-77-3 Catalog No: AG001ZPH MDL No:MFCD08166340
Product Description
Catalog Number:
AG001ZPH
Chemical Name:
Quinoline, 2-(phenylmethyl)-
CAS Number:
1745-77-3
Molecular Formula:
C16H13N
Molecular Weight:
219.2811
MDL Number:
MFCD08166340
IUPAC Name:
2-benzylquinoline
InChI:
InChI=1S/C16H13N/c1-2-6-13(7-3-1)12-15-11-10-14-8-4-5-9-16(14)17-15/h1-11H,12H2
InChI Key:
LLVHFJHCODIQJH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cc1ccc2c(n1)cccc2
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.105g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.287g/mol
Monoisotopic Mass:
219.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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