Home Carboxys Methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate

Methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate

CAS No.:
25016-19-7
Catalog Number:
AG00CD0C
Molecular Formula:
C8H12N2O2
Molecular Weight:
168.1931
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$147
- +
250mg
95%
In Stock USA
United States
$252
- +
1g
95%
In Stock USA
United States
$504
- +
5g
95%
In Stock USA
United States
$1512
- +
Product Description
Catalog Number:
AG00CD0C
Chemical Name:
Methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate
CAS Number:
25016-19-7
Molecular Formula:
C8H12N2O2
Molecular Weight:
168.1931
MDL Number:
MFCD06203736
IUPAC Name:
methyl 1,3,5-trimethylpyrazole-4-carboxylate
InChI:
InChI=1S/C8H12N2O2/c1-5-7(8(11)12-4)6(2)10(3)9-5/h1-4H3
InChI Key:
HLWLTTYQUCADCB-UHFFFAOYSA-N
SMILES:
COC(=O)c1c(C)nn(c1C)C
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.09g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.196g/mol
Monoisotopic Mass:
168.09g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties