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Home > Fluorides > 1260759-82-7
1260759-82-7 | 1H-Indole-3-carbonitrile, 4-fluoro-
CAS No: 1260759-82-7 Catalog No: AG000R4F MDL No:MFCD15527152
Product Description
Catalog Number:
AG000R4F
Chemical Name:
1H-Indole-3-carbonitrile, 4-fluoro-
CAS Number:
1260759-82-7
Molecular Formula:
C9H5FN2
Molecular Weight:
160.1478
MDL Number:
MFCD15527152
IUPAC Name:
4-fluoro-1H-indole-3-carbonitrile
InChI:
InChI=1S/C9H5FN2/c10-7-2-1-3-8-9(7)6(4-11)5-12-8/h1-3,5,12H
InChI Key:
YVNUHMSVHFAOBK-UHFFFAOYSA-N
SMILES:
N#Cc1c[nH]c2c1c(F)ccc2
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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