Name: Name:4-nitro-5-propyl-1H-pyrazole-3-carboxylic acid
Brand: Angene
SKU: AG01A837
Rating: 90 (10 reviews)

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

CAS No.:

76424-48-1

Catalog Number:

AG01A837

Molecular Formula:

C7H9N3O4

Molecular Weight:

199.1641

Catalog Number:

AG01A837

Chemical Name:

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

CAS Number:

76424-48-1

Molecular Formula:

C7H9N3O4

Molecular Weight:

199.1641

MDL Number:

MFCD09053119

IUPAC Name:

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

InChI:

InChI=1S/C7H9N3O4/c1-2-3-4-6(10(13)14)5(7(11)12)9-8-4/h2-3H2,1H3,(H,8,9)(H,11,12)

InChI Key:

WTLTYNIWFANVBQ-UHFFFAOYSA-N

SMILES:

CCCc1[nH]nc(c1[N+](=O)[O-])C(=O)O

Complexity:

240

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

199.059g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

199.166g/mol

Monoisotopic Mass:

199.059g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

112A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1