Home Carboxys sodium 1-methyl-5-(4H-1,2,4-triazol-4-yl)-1H-pyrazole-4-carboxylate

sodium 1-methyl-5-(4H-1,2,4-triazol-4-yl)-1H-pyrazole-4-carboxylate

CAS No.:
1803607-20-6
Catalog Number:
AG01AG6S
Molecular Formula:
C7H6N5NaO2
Molecular Weight:
215.1446
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AG6S
Chemical Name:
sodium 1-methyl-5-(4H-1,2,4-triazol-4-yl)-1H-pyrazole-4-carboxylate
CAS Number:
1803607-20-6
Molecular Formula:
C7H6N5NaO2
Molecular Weight:
215.1446
MDL Number:
MFCD27920361
IUPAC Name:
sodium;1-methyl-5-(1,2,4-triazol-4-yl)pyrazole-4-carboxylate
InChI:
InChI=1S/C7H7N5O2.Na/c1-11-6(12-3-8-9-4-12)5(2-10-11)7(13)14;/h2-4H,1H3,(H,13,14);/q;+1/p-1
InChI Key:
KIVFPLPJBRJAMZ-UHFFFAOYSA-M
SMILES:
Cn1ncc(c1n1cnnc1)C(=O)[O-].[Na+]
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.042g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.148g/mol
Monoisotopic Mass:
215.042g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
88.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties