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89210-56-0 | 3H-Pyrazole, 5-(difluoromethylene)-4,5-dihydro-3,3-dimethyl-
CAS No: 89210-56-0 Catalog No: AG0043TS MDL No:
Product Description
Catalog Number:
AG0043TS
Chemical Name:
3H-Pyrazole, 5-(difluoromethylene)-4,5-dihydro-3,3-dimethyl-
CAS Number:
89210-56-0
Molecular Formula:
C6H8F2N2
Molecular Weight:
146.1379
IUPAC Name:
5-(difluoromethylidene)-3,3-dimethyl-4H-pyrazole
InChI:
InChI=1S/C6H8F2N2/c1-6(2)3-4(5(7)8)9-10-6/h3H2,1-2H3
InChI Key:
XOLGTWCHHHXHFQ-UHFFFAOYSA-N
SMILES:
FC(=C1N=NC(C1)(C)C)F
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.066g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.141g/mol
Monoisotopic Mass:
146.066g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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