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Home Halogens 1H-Pyrazole-4-carboxylic acid, 5-amino-1-(2-chlorophenyl)-, ethyl ester, hydrochloride (1:1)

1H-Pyrazole-4-carboxylic acid, 5-amino-1-(2-chlorophenyl)-, ethyl ester, hydrochloride (1:1)

CAS No.:
1253791-51-3
Catalog Number:
AG000NKO
Molecular Formula:
C12H13Cl2N3O2
Molecular Weight:
302.1565
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$70
- +
250mg
95%
In Stock USA
United States
$126
- +
1g
95%
In Stock USA
United States
$252
- +
Product Description
Catalog Number:
AG000NKO
Chemical Name:
1H-Pyrazole-4-carboxylic acid, 5-amino-1-(2-chlorophenyl)-, ethyl ester, hydrochloride (1:1)
CAS Number:
1253791-51-3
Molecular Formula:
C12H13Cl2N3O2
Molecular Weight:
302.1565
MDL Number:
MFCD17215084
IUPAC Name:
ethyl 5-amino-1-(2-chlorophenyl)pyrazole-4-carboxylate;hydrochloride
InChI:
InChI=1S/C12H12ClN3O2.ClH/c1-2-18-12(17)8-7-15-16(11(8)14)10-6-4-3-5-9(10)13;/h3-7H,2,14H2,1H3;1H
InChI Key:
YPFNQAWVMMGKBQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnn(c1N)c1ccccc1Cl.Cl
Properties
Complexity:
303  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.038g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
302.155g/mol
Monoisotopic Mass:
301.038g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
70.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties