Name: Name:3-amino-1-(4-cyano-2-fluorophenyl)-1H-pyrazole-4-carbonitrile
Brand: Angene
SKU: AG01AH2X
Rating: 90 (10 reviews)

3-amino-1-(4-cyano-2-fluorophenyl)-1H-pyrazole-4-carbonitrile

CAS No.:

1311314-05-2

Catalog Number:

AG01AH2X

Molecular Formula:

C11H6FN5

Molecular Weight:

227.1972

Catalog Number:

AG01AH2X

Chemical Name:

3-amino-1-(4-cyano-2-fluorophenyl)-1H-pyrazole-4-carbonitrile

CAS Number:

1311314-05-2

Molecular Formula:

C11H6FN5

Molecular Weight:

227.1972

MDL Number:

MFCD18483187

IUPAC Name:

3-amino-1-(4-cyano-2-fluorophenyl)pyrazole-4-carbonitrile

InChI:

InChI=1S/C11H6FN5/c12-9-3-7(4-13)1-2-10(9)17-6-8(5-14)11(15)16-17/h1-3,6H,(H2,15,16)

InChI Key:

SYYVQHYAQNIJAY-UHFFFAOYSA-N

SMILES:

N#Cc1ccc(c(c1)F)n1nc(c(c1)C#N)N

Complexity:

380

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

227.061g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

227.202g/mol

Monoisotopic Mass:

227.061g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.6