Basic information
- CAS
10042-89-4- Standard SMILES
CCCCOC(=O)CC(SC(CC(=O)OCCCC)C(=O)OCCCC)C(=O)OCCCC- InChIKey
QEFOHLDZJZYQEZ-UHFFFAOYSA-N- Molecular formula
- C24H42O8S
- Average molar mass
- 490.7 g/mol
- Monoisotopic mass
- 490.26003947
Names & identifiers
- Preferred name
- Tetrabutyl thiodisuccinate
- IUPAC
- dibutyl 2-(1,4-dibutoxy-1,4-dioxobutan-2-yl)sulfanylbutanedioate
- English name
- 2,2'-Thiodisuccinic acid tetrabutyl ester
- Molecular weight
- 0
Names & synonyms
Tetrabutyl thiodisuccinate10042-89-4Succinic acid, thiodi-, tetrabutyl esterCEX88S9XJKNSC 22380BRN 1810246Butanedioic acid, 2,2'-thiobis-, tetrabutyl esterUNII-CEX88S9XJKNSC-223804-03-00-01140 (Beilstein Handbook Reference)RefChem:188402Butanedioic acid, 2,2'-thiobis-, tetrabutyl ester (9CI)
Show more names
2,2'-Thiodisuccinic acid tetrabutyl ester2,2'-Thiobis(butanedioic acid)tetrabutyl ester
dibutyl 2-(1,4-dibutoxy-1,4-dioxobutan-2-yl)sulfanylbutanedioate2,2/'-Thiodisuccinic acid tetrabutyl esterSuccinic acid, tetrabutyl esterSCHEMBL11547557WLN: 4OV1YVO4& 2SDTXSID90905474NSC22380tetrabutyl 2,2'-sulfanediyldibutanedioate
Database identifiers
- CAS
10042-89-4- PubChem CID
- 95182
- DTXSID
DTXSID90905474- UNII
- CEX88S9XJK
- Nikkaji
- J49.504B
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 131 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 24
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 519
Physicochemical properties
- FDA UNII
- 88 S9XJK · CEX88S9XJK
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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