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1175788-58-5 | 4-Iodo-1-vinyl-1H-pyrazole
CAS No: 1175788-58-5 Catalog No: AG007QX4 MDL No:MFCD12198431
Product Description
Catalog Number:
AG007QX4
Chemical Name:
4-Iodo-1-vinyl-1H-pyrazole
CAS Number:
1175788-58-5
Molecular Formula:
C5H5IN2
Molecular Weight:
220.0111
MDL Number:
MFCD12198431
IUPAC Name:
1-ethenyl-4-iodopyrazole
InChI:
InChI=1S/C5H5IN2/c1-2-8-4-5(6)3-7-8/h2-4H,1H2
InChI Key:
ZBUGBGHFOYSENG-UHFFFAOYSA-N
SMILES:
Ic1cn(nc1)C=C
Properties
Complexity:
94.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.95g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
220.013g/mol
Monoisotopic Mass:
219.95g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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