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2-sulfanylethyl 3-{[3-oxo-3-(2-sulfanylethoxy)propyl]sulfanyl}propanoate

2-sulfanylethyl 3-{[3-oxo-3-(2-sulfanylethoxy)propyl]sulfanyl}propanoate

CAS: 68480-16-0

Formula: C10H18O4S3

SMILES: SCCOC(=O)CCSCCC(=O)OCCS

IUPAC: 2-sulfanylethyl 3-{[3-oxo-3-(2-sulfanylethoxy)propyl]sulfanyl}propanoate

InChI: InChI=1S/C10H18O4S3/c11-9(13-3-5-15)1-7-17-8-2-10(12)14-4-6-16/h15-16H,1-8H2

Composition: C (40.25%), H (6.08%), O (21.44%), S (32.23%)

Molar Mass: 298.43

Atom Count: 35

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 298.036722582
Formal Charge 0
FSP3 0.8
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey FZSIEPOWYMJQCT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.05
Topological Polar Surface Area 52.6
Polarizability 29.91
Ring Count 0
Rotatable Bond Count 12

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