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Home > Fluorides > 883500-88-7
883500-88-7 | 5-CYANO-7-FLUOROINDOLE
CAS No: 883500-88-7 Catalog No: AG00476E MDL No:
Product Description
Catalog Number:
AG00476E
Chemical Name:
5-CYANO-7-FLUOROINDOLE
CAS Number:
883500-88-7
Molecular Formula:
C9H5FN2
Molecular Weight:
160.1478
IUPAC Name:
7-fluoro-1H-indole-5-carbonitrile
InChI:
InChI=1S/C9H5FN2/c10-8-4-6(5-11)3-7-1-2-12-9(7)8/h1-4,12H
InChI Key:
XPJWXNPTGJIGIL-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)c2c(c1)cc[nH]2
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.044g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
160.151g/mol
Monoisotopic Mass:
160.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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