methyl 2,4-dichloro-5-(pyrrolidine-1-sulfonyl)benzoate

methyl 2,4-dichloro-5-(pyrrolidine-1-sulfonyl)benzoate

Formula: C12H13Cl2NO4S

SMILES: COC(=O)C1=CC(=C(Cl)C=C1Cl)S(=O)(=O)N1CCCC1

IUPAC: methyl 2,4-dichloro-5-(pyrrolidine-1-sulfonyl)benzoate

InChI: InChI=1S/C12H13Cl2NO4S/c1-19-12(16)8-6-11(10(14)7-9(8)13)20(17,18)15-4-2-3-5-15/h6-7H,2-5H2,1H3

Composition: C (42.62%), H (3.87%), Cl (20.96%), N (4.14%), O (18.92%), S (9.48%)

Molar Mass: 338.2

Atom Count: 33

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	336.9942345
Formal Charge	0
FSP3	0.42
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	LULPYSIGRPGUQD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	77.19
Topological Polar Surface Area	63.68
Polarizability	30.66
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H13Cl2NO4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00