Home Carboxys ethyl 1H-pyrazole-4-carboxylate hydrochloride

ethyl 1H-pyrazole-4-carboxylate hydrochloride

CAS No.:
1242339-75-8
Catalog Number:
AG01A5F7
Molecular Formula:
C6H9ClN2O2
Molecular Weight:
176.6009
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
1 week
United States
$59
- +
5g
98%
1 week
United States
$64
- +
25g
98%
1 week
United States
$127
- +
100g
98%
1 week
United States
$350
- +
Product Description
Catalog Number:
AG01A5F7
Chemical Name:
ethyl 1H-pyrazole-4-carboxylate hydrochloride
CAS Number:
1242339-75-8
Molecular Formula:
C6H9ClN2O2
Molecular Weight:
176.6009
MDL Number:
MFCD16038569
IUPAC Name:
ethyl 1H-pyrazole-4-carboxylate;hydrochloride
InChI:
InChI=1S/C6H8N2O2.ClH/c1-2-10-6(9)5-3-7-8-4-5;/h3-4H,2H2,1H3,(H,7,8);1H
InChI Key:
NILLKQABODQIFV-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c[nH]nc1.Cl
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.035g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
176.6g/mol
Monoisotopic Mass:
176.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties