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Home > Indoles and Oxindole > 14120-25-3
14120-25-3 | 8-methyl-1,3,4,5-tetrahydrothiopyrano[4,3-b]indole
CAS No: 14120-25-3 Catalog No: AG006YY7 MDL No:
Product Description
Catalog Number:
AG006YY7
Chemical Name:
8-methyl-1,3,4,5-tetrahydrothiopyrano[4,3-b]indole
CAS Number:
14120-25-3
Molecular Formula:
C12H13NS
Molecular Weight:
203.3033
IUPAC Name:
8-methyl-1,3,4,5-tetrahydrothiopyrano[4,3-b]indole
InChI:
InChI=1S/C12H13NS/c1-8-2-3-11-9(6-8)10-7-14-5-4-12(10)13-11/h2-3,6,13H,4-5,7H2,1H3
InChI Key:
XKUMFDBGSQRHHT-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)c1CSCCc1[nH]2
NSC Number:
150794
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.077g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.303g/mol
Monoisotopic Mass:
203.077g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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