Name: Name:5-chloro-3-ethyl-1-methyl-4-nitro-1H-pyrazole
Brand: Angene
SKU: AG019SUR
Rating: 90 (10 reviews)

5-chloro-3-ethyl-1-methyl-4-nitro-1H-pyrazole

CAS No.:

13586-54-4

Catalog Number:

AG019SUR

Molecular Formula:

C6H8ClN3O2

Molecular Weight:

189.5996

Catalog Number:

AG019SUR

Chemical Name:

5-chloro-3-ethyl-1-methyl-4-nitro-1H-pyrazole

CAS Number:

13586-54-4

Molecular Formula:

C6H8ClN3O2

Molecular Weight:

189.5996

MDL Number:

MFCD09727784

IUPAC Name:

5-chloro-3-ethyl-1-methyl-4-nitropyrazole

InChI:

InChI=1S/C6H8ClN3O2/c1-3-4-5(10(11)12)6(7)9(2)8-4/h3H2,1-2H3

InChI Key:

AEMZISRFJQRMBE-UHFFFAOYSA-N

SMILES:

CCc1nn(c(c1[N+](=O)[O-])Cl)C

Complexity:

184

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

189.031g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

189.599g/mol

Monoisotopic Mass:

189.031g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9