Name: Name:5-amino-1-(4-chloro-3-fluorophenyl)-1H-pyrazole-4-carbonitrile
Brand: Angene
SKU: AG01B4GJ
Rating: 90 (10 reviews)

5-amino-1-(4-chloro-3-fluorophenyl)-1H-pyrazole-4-carbonitrile

CAS No.:

1506744-53-1

Catalog Number:

AG01B4GJ

Molecular Formula:

C10H6ClFN4

Molecular Weight:

236.6328

Catalog Number:

AG01B4GJ

Chemical Name:

5-amino-1-(4-chloro-3-fluorophenyl)-1H-pyrazole-4-carbonitrile

CAS Number:

1506744-53-1

Molecular Formula:

C10H6ClFN4

Molecular Weight:

236.6328

MDL Number:

MFCD21807872

IUPAC Name:

5-amino-1-(4-chloro-3-fluorophenyl)pyrazole-4-carbonitrile

InChI:

InChI=1S/C10H6ClFN4/c11-8-2-1-7(3-9(8)12)16-10(14)6(4-13)5-15-16/h1-3,5H,14H2

InChI Key:

FHUVKJXCHYDELH-UHFFFAOYSA-N

SMILES:

N#Cc1cnn(c1N)c1ccc(c(c1)F)Cl

Complexity:

304

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.027g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.634g/mol

Monoisotopic Mass:

236.027g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5