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Home > Indoles and Oxindole > 1105193-68-7
1105193-68-7 | 5-(ISOTHIOCYANATOMETHYL)-2-METHYL-1H-INDOLE
CAS No: 1105193-68-7 Catalog No: AG01AQL6 MDL No:MFCD16652917
Product Description
Catalog Number:
AG01AQL6
Chemical Name:
5-(ISOTHIOCYANATOMETHYL)-2-METHYL-1H-INDOLE
CAS Number:
1105193-68-7
MDL Number:
MFCD16652917
IUPAC Name:
5-(isothiocyanatomethyl)-2-methyl-1H-indole
InChI:
InChI=1S/C11H10N2S/c1-8-4-10-5-9(6-12-7-14)2-3-11(10)13-8/h2-5,13H,6H2,1H3
InChI Key:
JJFUZUQJWWTFTG-UHFFFAOYSA-N
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.056g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.275g/mol
Monoisotopic Mass:
202.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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