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Home > Indoles and Oxindole > 13637-38-2
13637-38-2 | 2H-Indole-2-thione, 1,3-dihydro-1-methyl-
CAS No: 13637-38-2 Catalog No: AG0011SX MDL No:MFCD18809114
Product Description
Catalog Number:
AG0011SX
Chemical Name:
2H-Indole-2-thione, 1,3-dihydro-1-methyl-
CAS Number:
13637-38-2
Molecular Formula:
C9H9NS
Molecular Weight:
163.2395
MDL Number:
MFCD18809114
IUPAC Name:
1-methyl-3H-indole-2-thione
InChI:
InChI=1S/C9H9NS/c1-10-8-5-3-2-4-7(8)6-9(10)11/h2-5H,6H2,1H3
InChI Key:
GBSPZRWQIJCQQB-UHFFFAOYSA-N
SMILES:
S=C1Cc2c(N1C)cccc2
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.046g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
163.238g/mol
Monoisotopic Mass:
163.046g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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