Basic information
- CAS
6303-03-3- Standard SMILES
C=CCOC(=O)CSCC(=O)OCC=C- InChIKey
ABEBWTHQUYXXHD-UHFFFAOYSA-N- Molecular formula
- C10H14O4S
- Average molar mass
- 230.28 g/mol
- Monoisotopic mass
- 230.0612801
Names & identifiers
- Preferred name
- Diallyl thiodiacetate
- IUPAC
- prop-2-enyl 2-(2-oxo-2-prop-2-enoxyethyl)sulfanylacetate
- English name
- Thiodiacetic acid diallyl ester
- Molecular formula
- C10H14O4S
- Molecular weight
- 0
Names & synonyms
Diallyl thiodiacetateACETIC ACID, THIODI-, DIALLYL ESTER6303-03-3DP7Z8U5UV4NSC 42204NSC-42204UNII-DP7Z8U5UV4DTXSID70212315Dimethylsulfide-alpha,alpha'-dicarboxylic acid diallyl esterRefChem:200488DTXCID70134806WLN: 1U2OV1S1VO2U1
Show more names
Thiodiacetic acid diallyl esterprop-2-enyl 2-(2-oxo-2-prop-2-enoxyethyl)sulfanylacetate
NSC42204Dimethylsulfide-.alpha., diallyl esterDi(prop-2-en-1-yl) 2,2'-sulfanediyldiacetate
Database identifiers
- CAS
6303-03-3- PubChem CID
- 22740
- DTXSID
DTXSID70212315- UNII
- DP7Z8U5UV4
- Nikkaji
- J54.976B
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 77.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 214
Physicochemical properties
- FDA UNII
- 7 Z8U5UV4 · DP7Z8U5UV4
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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