Name: Name:methyl 5-(2-chlorophenyl)-1H-pyrazole-3-carboxylate
Brand: Angene
SKU: AG01A3T4
Rating: 90 (10 reviews)

methyl 5-(2-chlorophenyl)-1H-pyrazole-3-carboxylate

CAS No.:

1187339-06-5

Catalog Number:

AG01A3T4

Molecular Formula:

C11H9ClN2O2

Molecular Weight:

236.6544

Catalog Number:

AG01A3T4

Chemical Name:

methyl 5-(2-chlorophenyl)-1H-pyrazole-3-carboxylate

CAS Number:

1187339-06-5

Molecular Formula:

C11H9ClN2O2

Molecular Weight:

236.6544

MDL Number:

MFCD19691767

IUPAC Name:

methyl 3-(2-chlorophenyl)-1H-pyrazole-5-carboxylate

InChI:

InChI=1S/C11H9ClN2O2/c1-16-11(15)10-6-9(13-14-10)7-4-2-3-5-8(7)12/h2-6H,1H3,(H,13,14)

InChI Key:

WYXZSFZLTLCERD-UHFFFAOYSA-N

SMILES:

COC(=O)c1n[nH]c(c1)c1ccccc1Cl

Complexity:

262

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

236.035g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

236.655g/mol

Monoisotopic Mass:

236.035g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7