Name: Name:ethyl 2-[4-formyl-3-(4-methoxyphenyl)-1H-pyrazol-1-yl]acetate
Brand: Angene
SKU: AG01C02H
Rating: 90 (10 reviews)

ethyl 2-[4-formyl-3-(4-methoxyphenyl)-1H-pyrazol-1-yl]acetate

CAS No.:

887408-03-9

Catalog Number:

AG01C02H

Molecular Formula:

C15H16N2O4

Molecular Weight:

288.2985

Catalog Number:

AG01C02H

Chemical Name:

ethyl 2-[4-formyl-3-(4-methoxyphenyl)-1H-pyrazol-1-yl]acetate

CAS Number:

887408-03-9

Molecular Formula:

C15H16N2O4

Molecular Weight:

288.2985

MDL Number:

MFCD06662337

IUPAC Name:

ethyl 2-[4-formyl-3-(4-methoxyphenyl)pyrazol-1-yl]acetate

InChI:

InChI=1S/C15H16N2O4/c1-3-21-14(19)9-17-8-12(10-18)15(16-17)11-4-6-13(20-2)7-5-11/h4-8,10H,3,9H2,1-2H3

InChI Key:

RLJVGKJPVKSBBO-UHFFFAOYSA-N

SMILES:

CCOC(=O)Cn1cc(c(n1)c1ccc(cc1)OC)C=O

Complexity:

356

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

288.111g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

288.303g/mol

Monoisotopic Mass:

288.111g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7