Name: Name:1H-Pyrazole-4-carbonitrile, 5-amino-1-(2-methoxyphenyl)-
Brand: Angene
SKU: AG006TLE
Rating: 90 (10 reviews)

1H-Pyrazole-4-carbonitrile, 5-amino-1-(2-methoxyphenyl)-

CAS No.:

650628-19-6

Catalog Number:

AG006TLE

Molecular Formula:

C11H10N4O

Molecular Weight:

214.2233

Catalog Number:

AG006TLE

Chemical Name:

1H-Pyrazole-4-carbonitrile, 5-amino-1-(2-methoxyphenyl)-

CAS Number:

650628-19-6

Molecular Formula:

C11H10N4O

Molecular Weight:

214.2233

MDL Number:

MFCD00128342

IUPAC Name:

5-amino-1-(2-methoxyphenyl)pyrazole-4-carbonitrile

InChI:

InChI=1S/C11H10N4O/c1-16-10-5-3-2-4-9(10)15-11(13)8(6-12)7-14-15/h2-5,7H,13H2,1H3

InChI Key:

BVTDTJIVDSFGOW-UHFFFAOYSA-N

SMILES:

COc1ccccc1n1ncc(c1N)C#N

Complexity:

287

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.228g/mol

Monoisotopic Mass:

214.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

76.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8