Name: Name:ethyl 5-formyl-1-phenyl-1H-pyrazole-4-carboxylate
Brand: Angene
SKU: AG01C1TJ
Rating: 90 (10 reviews)

ethyl 5-formyl-1-phenyl-1H-pyrazole-4-carboxylate

CAS No.:

40995-43-5

Catalog Number:

AG01C1TJ

Molecular Formula:

C13H12N2O3

Molecular Weight:

244.2460

Catalog Number:

AG01C1TJ

Chemical Name:

ethyl 5-formyl-1-phenyl-1H-pyrazole-4-carboxylate

CAS Number:

40995-43-5

Molecular Formula:

C13H12N2O3

Molecular Weight:

244.2460

MDL Number:

MFCD29762675

IUPAC Name:

ethyl 5-formyl-1-phenylpyrazole-4-carboxylate

InChI:

InChI=1S/C13H12N2O3/c1-2-18-13(17)11-8-14-15(12(11)9-16)10-6-4-3-5-7-10/h3-9H,2H2,1H3

InChI Key:

WQOHUJHHYMVBTB-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cnn(c1C=O)c1ccccc1

Complexity:

303

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

244.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

244.25g/mol

Monoisotopic Mass:

244.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9