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Home Halogens Ethyl 1-(3-chlorophenyl)-3-methyl-1H-pyrazole-5-carboxylate

Ethyl 1-(3-chlorophenyl)-3-methyl-1H-pyrazole-5-carboxylate

CAS No.:
709654-29-5
Catalog Number:
AG00626K
Molecular Formula:
C13H13ClN2O2
Molecular Weight:
264.7075
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG00626K
Chemical Name:
Ethyl 1-(3-chlorophenyl)-3-methyl-1H-pyrazole-5-carboxylate
CAS Number:
709654-29-5
Molecular Formula:
C13H13ClN2O2
Molecular Weight:
264.7075
MDL Number:
MFCD23115276
IUPAC Name:
ethyl 2-(3-chlorophenyl)-5-methylpyrazole-3-carboxylate
InChI:
InChI=1S/C13H13ClN2O2/c1-3-18-13(17)12-7-9(2)15-16(12)11-6-4-5-10(14)8-11/h4-8H,3H2,1-2H3
InChI Key:
LHVLVYGKPASASS-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc(nn1c1cccc(c1)Cl)C
Properties
Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.067g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.709g/mol
Monoisotopic Mass:
264.067g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties