Name: Name:5-(2,6-difluorophenyl)-1-methyl-1H-pyrazole-3-carbonitrile
Brand: Angene
SKU: AG01DK67
Rating: 90 (10 reviews)

5-(2,6-difluorophenyl)-1-methyl-1H-pyrazole-3-carbonitrile

CAS No.:

1361019-09-1

Catalog Number:

AG01DK67

Molecular Formula:

C11H7F2N3

Molecular Weight:

219.1902

Catalog Number:

AG01DK67

Chemical Name:

5-(2,6-difluorophenyl)-1-methyl-1H-pyrazole-3-carbonitrile

CAS Number:

1361019-09-1

Molecular Formula:

C11H7F2N3

Molecular Weight:

219.1902

MDL Number:

MFCD31652687

IUPAC Name:

5-(2,6-difluorophenyl)-1-methylpyrazole-3-carbonitrile

InChI:

InChI=1S/C11H7F2N3/c1-16-10(5-7(6-14)15-16)11-8(12)3-2-4-9(11)13/h2-5H,1H3

InChI Key:

AUAXASJTWUZQBS-UHFFFAOYSA-N

SMILES:

N#Cc1nn(c(c1)c1c(F)cccc1F)C

Complexity:

291

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

219.061g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

219.195g/mol

Monoisotopic Mass:

219.061g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

41.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.1