methyl 5-(chlorosulfonyl)furan-2-carboxylate

methyl 5-(chlorosulfonyl)furan-2-carboxylate

CAS: 69816-05-3

Formula: C6H5ClO5S

SMILES: COC(=O)C1=CC=C(O1)S(Cl)(=O)=O

IUPAC: methyl 5-(chlorosulfonyl)furan-2-carboxylate

InChI: InChI=1S/C6H5ClO5S/c1-11-6(8)4-2-3-5(12-4)13(7,9)10/h2-3H,1H3

Composition: C (32.08%), H (2.24%), Cl (15.78%), O (35.61%), S (14.27%)

Molar Mass: 224.61

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	223.9546221
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	JYWNJCAFWPZETG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.92
Topological Polar Surface Area	73.58
Polarizability	18.02
Ring Count	1
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	69816-05-3		$452.30-$670.68$452.30$670.68