Name: Name:ethyl 2-(4-cyano-5-imino-2,5-dihydro-1H-pyrazol-1-yl)acetate
Brand: Angene
SKU: AG01AAZE
Rating: 90 (10 reviews)

ethyl 2-(4-cyano-5-imino-2,5-dihydro-1H-pyrazol-1-yl)acetate

CAS No.:

1356641-11-6

Catalog Number:

AG01AAZE

Molecular Formula:

C8H10N4O2

Molecular Weight:

194.1906

Catalog Number:

AG01AAZE

Chemical Name:

ethyl 2-(4-cyano-5-imino-2,5-dihydro-1H-pyrazol-1-yl)acetate

CAS Number:

1356641-11-6

Molecular Formula:

C8H10N4O2

Molecular Weight:

194.1906

MDL Number:

MFCD26143904

IUPAC Name:

ethyl 2-(5-amino-4-cyanopyrazol-1-yl)acetate

InChI:

InChI=1S/C8H10N4O2/c1-2-14-7(13)5-12-8(10)6(3-9)4-11-12/h4H,2,5,10H2,1H3

InChI Key:

NSSNKNRHCAMPTJ-UHFFFAOYSA-N

SMILES:

CCOC(=O)Cn1[nH]cc(c1=N)C#N

Complexity:

259

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

194.08g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

194.194g/mol

Monoisotopic Mass:

194.08g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

93.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.5