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10222-10-3 | 8-Quinolinethiol, 2-methyl-
CAS No: 10222-10-3 Catalog No: AG0006Z2 MDL No:
Product Description
Catalog Number:
AG0006Z2
Chemical Name:
8-Quinolinethiol, 2-methyl-
CAS Number:
10222-10-3
Molecular Formula:
C10H9NS
Molecular Weight:
175.2502
IUPAC Name:
2-methylquinoline-8-thiol
InChI:
InChI=1S/C10H9NS/c1-7-5-6-8-3-2-4-9(12)10(8)11-7/h2-6,12H,1H3
InChI Key:
DUIAZPVQMPQZSK-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(n1)c(S)ccc2
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.046g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.249g/mol
Monoisotopic Mass:
175.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
13.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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