Name: Name:ethyl 2-(4-formyl-3-phenyl-1H-pyrazol-1-yl)acetate
Brand: Angene
SKU: AG01C00Z
Rating: 90 (10 reviews)

ethyl 2-(4-formyl-3-phenyl-1H-pyrazol-1-yl)acetate

CAS No.:

887408-01-7

Catalog Number:

AG01C00Z

Molecular Formula:

C14H14N2O3

Molecular Weight:

258.2726

Catalog Number:

AG01C00Z

Chemical Name:

ethyl 2-(4-formyl-3-phenyl-1H-pyrazol-1-yl)acetate

CAS Number:

887408-01-7

Molecular Formula:

C14H14N2O3

Molecular Weight:

258.2726

MDL Number:

MFCD06662336

IUPAC Name:

ethyl 2-(4-formyl-3-phenylpyrazol-1-yl)acetate

InChI:

InChI=1S/C14H14N2O3/c1-2-19-13(18)9-16-8-12(10-17)14(15-16)11-6-4-3-5-7-11/h3-8,10H,2,9H2,1H3

InChI Key:

HEBUXVQLLIKIKA-UHFFFAOYSA-N

SMILES:

CCOC(=O)Cn1cc(c(n1)c1ccccc1)C=O

Complexity:

316

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

258.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

258.277g/mol

Monoisotopic Mass:

258.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7