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99749-19-6 | Quinoline, 4-methyl-2-(phenylmethyl)-
CAS No: 99749-19-6 Catalog No: AG003W2U MDL No:
Product Description
Catalog Number:
AG003W2U
Chemical Name:
Quinoline, 4-methyl-2-(phenylmethyl)-
CAS Number:
99749-19-6
Molecular Formula:
C17H15N
Molecular Weight:
233.3077
IUPAC Name:
2-benzyl-4-methylquinoline
InChI:
InChI=1S/C17H15N/c1-13-11-15(12-14-7-3-2-4-8-14)18-17-10-6-5-9-16(13)17/h2-11H,12H2,1H3
InChI Key:
QRXYDFSIMGLXQI-UHFFFAOYSA-N
SMILES:
Cc1cc(Cc2ccccc2)nc2c1cccc2
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.12g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.314g/mol
Monoisotopic Mass:
233.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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