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Home > Indoles and Oxindole > 792857-19-3
792857-19-3 | 3-Indolizinecarbodithioicacid, 2-hydroxy-5-methyl-
CAS No: 792857-19-3 Catalog No: AG005L97 MDL No:
Product Description
Catalog Number:
AG005L97
Chemical Name:
3-Indolizinecarbodithioicacid, 2-hydroxy-5-methyl-
CAS Number:
792857-19-3
Molecular Formula:
C10H9NOS2
Molecular Weight:
223.3146
IUPAC Name:
2-hydroxy-5-methylindolizine-3-carbodithioic acid
InChI:
InChI=1S/C10H9NOS2/c1-6-3-2-4-7-5-8(12)9(10(13)14)11(6)7/h2-5,12H,1H3,(H,13,14)
InChI Key:
FWLLTLNTHLLCLN-UHFFFAOYSA-N
SMILES:
SC(=S)c1c(O)cc2n1c(C)ccc2
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.013g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
223.308g/mol
Monoisotopic Mass:
223.013g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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