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Home > Indoles and Oxindole > 146139-50-6
146139-50-6 | 1H-Indole-2-acetonitrile, 2,3-dihydro-
CAS No: 146139-50-6 Catalog No: AG001DQO MDL No:
Product Description
Catalog Number:
AG001DQO
Chemical Name:
1H-Indole-2-acetonitrile, 2,3-dihydro-
CAS Number:
146139-50-6
Molecular Formula:
C10H10N2
Molecular Weight:
158.1998
IUPAC Name:
2-(2,3-dihydro-1H-indol-2-yl)acetonitrile
InChI:
InChI=1S/C10H10N2/c11-6-5-9-7-8-3-1-2-4-10(8)12-9/h1-4,9,12H,5,7H2
InChI Key:
TZOGTECADNZKPF-UHFFFAOYSA-N
SMILES:
N#CCC1Cc2c(N1)cccc2
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.084g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
158.204g/mol
Monoisotopic Mass:
158.084g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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