Home Halogens Ethyl 5-chloro-1-methyl-1h-pyrazole-3-carboxylate

Ethyl 5-chloro-1-methyl-1h-pyrazole-3-carboxylate

CAS No.:
1172229-72-9
Catalog Number:
AG000DXX
Molecular Formula:
C7H9ClN2O2
Molecular Weight:
188.6116
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$255
- +
1g
95%
1 week
United States
$578
- +
Product Description
Catalog Number:
AG000DXX
Chemical Name:
Ethyl 5-chloro-1-methyl-1h-pyrazole-3-carboxylate
CAS Number:
1172229-72-9
Molecular Formula:
C7H9ClN2O2
Molecular Weight:
188.6116
MDL Number:
MFCD10699191
IUPAC Name:
ethyl 5-chloro-1-methylpyrazole-3-carboxylate
InChI:
InChI=1S/C7H9ClN2O2/c1-3-12-7(11)5-4-6(8)10(2)9-5/h4H,3H2,1-2H3
InChI Key:
NZXVQPKDTOICGR-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nn(c(c1)Cl)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:
188.035g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.611g/mol
Monoisotopic Mass:
188.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties