5-chloro-3-(morpholine-4-sulfonyl)thiophene-2-carboxylic acid

5-chloro-3-(morpholine-4-sulfonyl)thiophene-2-carboxylic acid

CAS: 948015-50-7

Formula: C9H10ClNO5S2

SMILES: OC(=O)C1=C(C=C(Cl)S1)S(=O)(=O)N1CCOCC1

IUPAC: 5-chloro-3-(morpholine-4-sulfonyl)thiophene-2-carboxylic acid

InChI: InChI=1S/C9H10ClNO5S2/c10-7-5-6(8(17-7)9(12)13)18(14,15)11-1-3-16-4-2-11/h5H,1-4H2,(H,12,13)

Composition: C (34.67%), H (3.23%), Cl (11.37%), N (4.49%), O (25.66%), S (20.57%)

Molar Mass: 311.75

Atom Count: 28

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	310.9688925
Formal Charge	0
FSP3	0.44
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	YZTUGMIATWHWJZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	65.19
Topological Polar Surface Area	83.91
Polarizability	26.27
Ring Count	2
Rotatable Bond Count	2

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