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Home > Indoles and Oxindole > 1391291-50-1
1391291-50-1 | 2-methyl-2,3-dihydro-1H-indole-6-carbonitrile
CAS No: 1391291-50-1 Catalog No: AG01EJQE MDL No:MFCD22518630
Product Description
Catalog Number:
AG01EJQE
Chemical Name:
2-methyl-2,3-dihydro-1H-indole-6-carbonitrile
CAS Number:
1391291-50-1
Molecular Formula:
C10H10N2
Molecular Weight:
158.1998
MDL Number:
MFCD22518630
IUPAC Name:
2-methyl-2,3-dihydro-1H-indole-6-carbonitrile
InChI:
InChI=1S/C10H10N2/c1-7-4-9-3-2-8(6-11)5-10(9)12-7/h2-3,5,7,12H,4H2,1H3
InChI Key:
XJXHWBHPBVIKGK-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)NC(C2)C
Properties
Complexity:
215
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:
0
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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