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Home > Fluorides > 1269293-60-8
1269293-60-8 | 1H-Pyrazole-4-carbonitrile, 5-fluoro-1-methyl-
CAS No: 1269293-60-8 Catalog No: AG000WED MDL No:MFCD17168486
Product Description
Catalog Number:
AG000WED
Chemical Name:
1H-Pyrazole-4-carbonitrile, 5-fluoro-1-methyl-
CAS Number:
1269293-60-8
Molecular Formula:
C5H4FN3
Molecular Weight:
125.1038
MDL Number:
MFCD17168486
IUPAC Name:
5-fluoro-1-methylpyrazole-4-carbonitrile
InChI:
InChI=1S/C5H4FN3/c1-9-5(6)4(2-7)3-8-9/h3H,1H3
InChI Key:
FPOCZSWNTKSRCQ-UHFFFAOYSA-N
SMILES:
N#Cc1cnn(c1F)C
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.039g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
125.106g/mol
Monoisotopic Mass:
125.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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