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15882-29-8 | 2,3-dihydro-1H-cyclopenta[c]quinoline-4-thiol
CAS No: 15882-29-8 Catalog No: AG00JGZR MDL No:MFCD01995682
Product Description
Catalog Number:
AG00JGZR
Chemical Name:
2,3-dihydro-1H-cyclopenta[c]quinoline-4-thiol
CAS Number:
15882-29-8
Molecular Formula:
C12H11NS
Molecular Weight:
201.2874
MDL Number:
MFCD01995682
IUPAC Name:
1,2,3,5-tetrahydrocyclopenta[c]quinoline-4-thione
InChI:
InChI=1S/C12H11NS/c14-12-10-6-3-5-8(10)9-4-1-2-7-11(9)13-12/h1-2,4,7H,3,5-6H2,(H,13,14)
InChI Key:
INEAHZZJVBJVOH-UHFFFAOYSA-N
SMILES:
Sc1nc2ccccc2c2c1CCC2
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.061g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
201.287g/mol
Monoisotopic Mass:
201.061g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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