Name: Name:ethyl 3-(1-methyl-1H-pyrazol-5-yl)-3-oxopropanoate
Brand: Angene
SKU: AG01E9TY
Rating: 90 (10 reviews)

ethyl 3-(1-methyl-1H-pyrazol-5-yl)-3-oxopropanoate

CAS No.:

1356404-50-6

Catalog Number:

AG01E9TY

Molecular Formula:

C9H12N2O3

Molecular Weight:

196.2032

Catalog Number:

AG01E9TY

Chemical Name:

ethyl 3-(1-methyl-1H-pyrazol-5-yl)-3-oxopropanoate

CAS Number:

1356404-50-6

Molecular Formula:

C9H12N2O3

Molecular Weight:

196.2032

IUPAC Name:

ethyl 3-(2-methylpyrazol-3-yl)-3-oxopropanoate

InChI:

InChI=1S/C9H12N2O3/c1-3-14-9(13)6-8(12)7-4-5-10-11(7)2/h4-5H,3,6H2,1-2H3

InChI Key:

CHMNXJORXWELAO-UHFFFAOYSA-N

SMILES:

CCOC(=O)CC(=O)c1ccnn1C

Complexity:

230

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

196.085g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

196.206g/mol

Monoisotopic Mass:

196.085g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

61.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.6