Home Other Building Blocks 3-(Difluoromethyl)-1-methyl-1H-pyrazol-5(4H)-one

3-(Difluoromethyl)-1-methyl-1H-pyrazol-5(4H)-one

CAS No.:
1048018-91-2
Catalog Number:
AG019EME
Molecular Formula:
C5H6F2N2O
Molecular Weight:
148.1107
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$252
- +
250mg
95%
In Stock USA
United States
$473
- +
1g
95%
In Stock USA
United States
$1229
- +
Product Description
Catalog Number:
AG019EME
Chemical Name:
3-(Difluoromethyl)-1-methyl-1H-pyrazol-5(4H)-one
CAS Number:
1048018-91-2
Molecular Formula:
C5H6F2N2O
Molecular Weight:
148.1107
MDL Number:
MFCD17240576
IUPAC Name:
5-(difluoromethyl)-2-methyl-4H-pyrazol-3-one
InChI:
InChI=1S/C5H6F2N2O/c1-9-4(10)2-3(8-9)5(6)7/h5H,2H2,1H3
InChI Key:
IDZHMJXCQWZTBQ-UHFFFAOYSA-N
SMILES:
FC(C1=NN(C(=O)C1)C)F
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.045g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
148.113g/mol
Monoisotopic Mass:
148.045g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties