Home Carboxys 3-Iodo-1-methyl-1h-pyrazole-4-carboxylic acid ethyl ester

3-Iodo-1-methyl-1h-pyrazole-4-carboxylic acid ethyl ester

CAS No.:
799835-39-5
Catalog Number:
AG00ID2X
Molecular Formula:
C7H9IN2O2
Molecular Weight:
280.0630
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$137
- +
250mg
95%
In Stock USA
United States
$246
- +
1g
95%
In Stock USA
United States
$492
- +
5g
95%
In Stock USA
United States
$1475
- +
Product Description
Catalog Number:
AG00ID2X
Chemical Name:
3-Iodo-1-methyl-1h-pyrazole-4-carboxylic acid ethyl ester
CAS Number:
799835-39-5
Molecular Formula:
C7H9IN2O2
Molecular Weight:
280.0630
MDL Number:
MFCD00297132
IUPAC Name:
ethyl 3-iodo-1-methylpyrazole-4-carboxylate
InChI:
InChI=1S/C7H9IN2O2/c1-3-12-7(11)5-4-10(2)9-6(5)8/h4H,3H2,1-2H3
InChI Key:
VKQPNWRQKHYCFP-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cn(nc1I)C
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.971g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.065g/mol
Monoisotopic Mass:
279.971g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties