Name: Name:methyl 3-(chlorosulfonyl)-1-methyl-1H-pyrazole-5-carboxylate
Brand: Angene
SKU: AG01AIR2
Rating: 90 (10 reviews)

methyl 3-(chlorosulfonyl)-1-methyl-1H-pyrazole-5-carboxylate

CAS No.:

1122567-32-1

Catalog Number:

AG01AIR2

Molecular Formula:

C6H7ClN2O4S

Molecular Weight:

238.6488

Catalog Number:

AG01AIR2

Chemical Name:

methyl 3-(chlorosulfonyl)-1-methyl-1H-pyrazole-5-carboxylate

CAS Number:

1122567-32-1

Molecular Formula:

C6H7ClN2O4S

Molecular Weight:

238.6488

MDL Number:

MFCD19201260

IUPAC Name:

methyl 5-chlorosulfonyl-2-methylpyrazole-3-carboxylate

InChI:

InChI=1S/C6H7ClN2O4S/c1-9-4(6(10)13-2)3-5(8-9)14(7,11)12/h3H,1-2H3

InChI Key:

VPCXPKBLPDHQFZ-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc(nn1C)S(=O)(=O)Cl

Complexity:

325

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

237.982g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

238.642g/mol

Monoisotopic Mass:

237.982g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

86.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8