Name: Name:ethyl 4-(chlorosulfonyl)-1-methyl-1H-pyrrole-2-carboxylate
Brand: Angene
SKU: AG01ABSS
Rating: 90 (10 reviews)

ethyl 4-(chlorosulfonyl)-1-methyl-1H-pyrrole-2-carboxylate

CAS No.:

868963-97-7

Catalog Number:

AG01ABSS

Molecular Formula:

C8H10ClNO4S

Molecular Weight:

251.6873

Catalog Number:

AG01ABSS

Chemical Name:

ethyl 4-(chlorosulfonyl)-1-methyl-1H-pyrrole-2-carboxylate

CAS Number:

868963-97-7

Molecular Formula:

C8H10ClNO4S

Molecular Weight:

251.6873

MDL Number:

MFCD21224754

IUPAC Name:

ethyl 4-chlorosulfonyl-1-methylpyrrole-2-carboxylate

InChI:

InChI=1S/C8H10ClNO4S/c1-3-14-8(11)7-4-6(5-10(7)2)15(9,12)13/h4-5H,3H2,1-2H3

InChI Key:

PIIKOURGUCCBAO-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cc(cn1C)S(=O)(=O)Cl

Complexity:

337

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

251.002g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

251.681g/mol

Monoisotopic Mass:

251.002g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

73.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2