Name: Name:ethyl 5-(diethoxymethyl)-1-phenyl-1H-pyrazole-4-carboxylate
Brand: Angene
SKU: AG01C26L
Rating: 90 (10 reviews)

ethyl 5-(diethoxymethyl)-1-phenyl-1H-pyrazole-4-carboxylate

CAS No.:

57397-75-8

Catalog Number:

AG01C26L

Molecular Formula:

C17H22N2O4

Molecular Weight:

318.3676

Catalog Number:

AG01C26L

Chemical Name:

ethyl 5-(diethoxymethyl)-1-phenyl-1H-pyrazole-4-carboxylate

CAS Number:

57397-75-8

Molecular Formula:

C17H22N2O4

Molecular Weight:

318.3676

MDL Number:

MFCD29762687

IUPAC Name:

ethyl 5-(diethoxymethyl)-1-phenylpyrazole-4-carboxylate

InChI:

InChI=1S/C17H22N2O4/c1-4-21-16(20)14-12-18-19(13-10-8-7-9-11-13)15(14)17(22-5-2)23-6-3/h7-12,17H,4-6H2,1-3H3

InChI Key:

XKJBBCVHRFRNBJ-UHFFFAOYSA-N

SMILES:

CCOC(c1c(cnn1c1ccccc1)C(=O)OCC)OCC

Complexity:

355

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

318.158g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

318.373g/mol

Monoisotopic Mass:

318.158g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.5