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Home > Indoles and Oxindole > 1373137-76-8
1373137-76-8 | 1H-Indole-3-carbonitrile, 7-formyl-1-methyl-
CAS No: 1373137-76-8 Catalog No: AG00132Z MDL No:
Product Description
Catalog Number:
AG00132Z
Chemical Name:
1H-Indole-3-carbonitrile, 7-formyl-1-methyl-
CAS Number:
1373137-76-8
Molecular Formula:
C11H8N2O
Molecular Weight:
184.1940
IUPAC Name:
7-formyl-1-methylindole-3-carbonitrile
InChI:
InChI=1S/C11H8N2O/c1-13-6-9(5-12)10-4-2-3-8(7-14)11(10)13/h2-4,6-7H,1H3
InChI Key:
WQMNXQASKZTSEG-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1n(C)cc2C#N
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.064g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.198g/mol
Monoisotopic Mass:
184.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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