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Home > Indoles and Oxindole > 91634-11-6
91634-11-6 | 1-METHYL-1H-INDOLE-5-CARBONITRILE
CAS No: 91634-11-6 Catalog No: AG00GRNX MDL No:MFCD09025840
Product Description
Catalog Number:
AG00GRNX
Chemical Name:
1-METHYL-1H-INDOLE-5-CARBONITRILE
CAS Number:
91634-11-6
Molecular Formula:
C10H8N2
Molecular Weight:
156.1839
MDL Number:
MFCD09025840
IUPAC Name:
1-methylindole-5-carbonitrile
InChI:
InChI=1S/C10H8N2/c1-12-5-4-9-6-8(7-11)2-3-10(9)12/h2-6H,1H3
InChI Key:
DYZZFEHAJOLDEX-UHFFFAOYSA-N
SMILES:
N#Cc1ccc2c(c1)ccn2C
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.069g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.188g/mol
Monoisotopic Mass:
156.069g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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