Name: Name:methyl 3-(4-ethylphenyl)-1H-pyrazole-5-carboxylate
Brand: Angene
SKU: AG01A0RN
Rating: 90 (10 reviews)

methyl 3-(4-ethylphenyl)-1H-pyrazole-5-carboxylate

CAS No.:

1044837-18-4

Catalog Number:

AG01A0RN

Molecular Formula:

C13H14N2O2

Molecular Weight:

230.2625

Catalog Number:

AG01A0RN

Chemical Name:

methyl 3-(4-ethylphenyl)-1H-pyrazole-5-carboxylate

CAS Number:

1044837-18-4

Molecular Formula:

C13H14N2O2

Molecular Weight:

230.2625

MDL Number:

MFCD07364354

IUPAC Name:

methyl 3-(4-ethylphenyl)-1H-pyrazole-5-carboxylate

InChI:

InChI=1S/C13H14N2O2/c1-3-9-4-6-10(7-5-9)11-8-12(15-14-11)13(16)17-2/h4-8H,3H2,1-2H3,(H,14,15)

InChI Key:

CIDCETQUURRJKO-UHFFFAOYSA-N

SMILES:

COC(=O)c1[nH]nc(c1)c1ccc(cc1)CC

Complexity:

262

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

230.106g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

230.267g/mol

Monoisotopic Mass:

230.106g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.9