Home Carboxys Methyl 3-methyl-1-phenyl-1h-pyrazole-5-carboxylate

Methyl 3-methyl-1-phenyl-1h-pyrazole-5-carboxylate

CAS No.:
55115-11-2
Catalog Number:
AG01DK37
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$44
- +
250mg
95%
In Stock USA
United States
$82
- +
1g
95%
In Stock USA
United States
$130
- +
Product Description
Catalog Number:
AG01DK37
Chemical Name:
Methyl 3-methyl-1-phenyl-1h-pyrazole-5-carboxylate
CAS Number:
55115-11-2
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
MDL Number:
MFCD31652818
IUPAC Name:
methyl 5-methyl-2-phenylpyrazole-3-carboxylate
InChI:
InChI=1S/C12H12N2O2/c1-9-8-11(12(15)16-2)14(13-9)10-6-4-3-5-7-10/h3-8H,1-2H3
InChI Key:
XQKCOSKXSLTXPE-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(nn1c1ccccc1)C
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties