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Home > Indoles and Oxindole > 84548-95-8
84548-95-8 | 2-(1-methyl-1H-indol-7-yl)acetonitrile
CAS No: 84548-95-8 Catalog No: AG01C7M2 MDL No:MFCD13183801
Product Description
Catalog Number:
AG01C7M2
Chemical Name:
2-(1-methyl-1H-indol-7-yl)acetonitrile
CAS Number:
84548-95-8
Molecular Formula:
C11H10N2
Molecular Weight:
170.2105
MDL Number:
MFCD13183801
IUPAC Name:
2-(1-methylindol-7-yl)acetonitrile
InChI:
InChI=1S/C11H10N2/c1-13-8-6-10-4-2-3-9(5-7-12)11(10)13/h2-4,6,8H,5H2,1H3
InChI Key:
RDPOKJNELSFVJV-UHFFFAOYSA-N
SMILES:
N#CCc1cccc2c1n(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:
1.7
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