Name: Name:3-ethyl-4-nitro-1H-pyrazole-5-carboxylic acid
Brand: Angene
SKU: AG00CG32
Rating: 90 (10 reviews)

3-ethyl-4-nitro-1H-pyrazole-5-carboxylic acid

CAS No.:

215298-72-9

Catalog Number:

AG00CG32

Molecular Formula:

C6H7N3O4

Molecular Weight:

185.1375

Catalog Number:

AG00CG32

Chemical Name:

3-ethyl-4-nitro-1H-pyrazole-5-carboxylic acid

CAS Number:

215298-72-9

Molecular Formula:

C6H7N3O4

Molecular Weight:

185.1375

MDL Number:

MFCD14706493

IUPAC Name:

5-ethyl-4-nitro-1H-pyrazole-3-carboxylic acid

InChI:

InChI=1S/C6H7N3O4/c1-2-3-5(9(12)13)4(6(10)11)8-7-3/h2H2,1H3,(H,7,8)(H,10,11)

InChI Key:

UDYWTLMYXXTHKR-UHFFFAOYSA-N

SMILES:

CCc1[nH]nc(c1[N+](=O)[O-])C(=O)O

Complexity:

226

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

185.044g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

185.139g/mol

Monoisotopic Mass:

185.044g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

112A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.7