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72076-54-1 | 6-Methyl-2-(phenylthio)quinoline
CAS No: 72076-54-1 Catalog No: AG00FVGL MDL No:
Product Description
Catalog Number:
AG00FVGL
Chemical Name:
6-Methyl-2-(phenylthio)quinoline
CAS Number:
72076-54-1
IUPAC Name:
6-methyl-2-phenylsulfanylquinoline
InChI:
InChI=1S/C16H13NS/c1-12-7-9-15-13(11-12)8-10-16(17-15)18-14-5-3-2-4-6-14/h2-11H,1H3
InChI Key:
MGBKIXGPXJZRIR-UHFFFAOYSA-N
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.077g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.347g/mol
Monoisotopic Mass:
251.077g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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