ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanyl]acetate

ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanyl]acetate

CAS: 925-47-3

Formula: C8H14O4S

SMILES: CCOC(=O)CSCC(=O)OCC

IUPAC: ethyl 2-[(2-ethoxy-2-oxoethyl)sulfanyl]acetate

InChI: InChI=1S/C8H14O4S/c1-3-11-7(9)5-13-6-8(10)12-4-2/h3-6H2,1-2H3

Composition: C (46.59%), H (6.84%), O (31.03%), S (15.54%)

Molar Mass: 206.26

Atom Count: 27

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	206.061280105
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	TVCSSJHLVLMADJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.39
Topological Polar Surface Area	52.6
Polarizability	20.14
Ring Count	0
Rotatable Bond Count	8

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