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Home > Indoles and Oxindole > 202584-24-5
202584-24-5 | 1-METHYL-1H-INDOLE-6-ACETONITRILE
CAS No: 202584-24-5 Catalog No: AG01DQV3 MDL No:MFCD12964886
Product Description
Catalog Number:
AG01DQV3
Chemical Name:
1-METHYL-1H-INDOLE-6-ACETONITRILE
CAS Number:
202584-24-5
Molecular Formula:
C11H10N2
Molecular Weight:
170.2105
MDL Number:
MFCD12964886
IUPAC Name:
2-(1-methylindol-6-yl)acetonitrile
InChI:
InChI=1S/C11H10N2/c1-13-7-5-10-3-2-9(4-6-12)8-11(10)13/h2-3,5,7-8H,4H2,1H3
InChI Key:
DOJDSKGYEPJCLL-UHFFFAOYSA-N
SMILES:
N#CCc1ccc2c(c1)n(C)cc2
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.084g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.215g/mol
Monoisotopic Mass:
170.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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