Basic information
- CAS
68298-36-2- Standard SMILES
CCCCCCCCC(=O)OCC[S][Sn]([CH2]CCC)([S]CCOC(=O)CCCCCCCC)[S]CCOC(=O)CCCCCCCC- InChIKey
CMTHBFGXMJZQBS-UHFFFAOYSA-K- Molecular formula
- C37H72O6S3Sn
- Average molar mass
- 827.9 g/mol
- Monoisotopic mass
- 828.351306
Names & identifiers
- Preferred name
- Nonanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester
- IUPAC
- 2-[butyl-bis(2-nonanoyloxyethylsulfanyl)stannyl]sulfanylethyl nonanoate
Names & synonyms
Butyltintris(2-nonanoyloxyethylmercaptide)EINECS 269-559-8Nonanoic acid, (butylstannylidyne)tris(thio-2,1-ethanediyl) esterNonanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) esterNonanoic acid, 1,1',1''-[(butylstannylidyne)tris(thio-2,1-ethanediyl)] esterRefChem:85458068298-36-2Butyltintris(2-mercaptoethyl nonanoate)((Butylstannanetriyl)tris(sulfanediyl))tris(ethane-2,1-diyl) trinonanoate(Butylstannylidyne)tris(thioethane-2,1-diyl) trinonanoateDTXSID5071385(Butylstannanetriyl)tris(sulfanediylethane-2,1-diyl) trinonanoate
Database identifiers
- CAS
68298-36-2- PubChem CID
- 109986
- DTXSID
DTXSID5071385- EC Number
- 269-559-8
Properties
Computed structural properties
- Topological polar surface area
- 155 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 39
- Heavy atoms
- 47
- Formal charge
- 0
- Complexity
- 655
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationNonanoic acid, 1,1',1''-[(butylstannylidyne)tris(thio-2,1-ethanediyl)] ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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