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Home > Indoles and Oxindole > 40015-14-3
40015-14-3 | 1H-Indole, 5-methyl-3-(methylthio)-
CAS No: 40015-14-3 Catalog No: AG00I7UH MDL No:
Product Description
Catalog Number:
AG00I7UH
Chemical Name:
1H-Indole, 5-methyl-3-(methylthio)-
CAS Number:
40015-14-3
IUPAC Name:
5-methyl-3-methylsulfanyl-1H-indole
InChI:
InChI=1S/C10H11NS/c1-7-3-4-9-8(5-7)10(12-2)6-11-9/h3-6,11H,1-2H3
InChI Key:
QRWMIHIBUBHCDF-UHFFFAOYSA-N
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.061g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.265g/mol
Monoisotopic Mass:
177.061g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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