Basic information
- CAS
23838-19-9- Standard SMILES
C/C=C/SSC- InChIKey
FUDUFCLRGSEHAJ-ONEGZZNKSA-N- Molecular formula
- C4H8S2
- Average molar mass
- 120.2 g/mol
- Monoisotopic mass
- 120.0067426
Names & identifiers
- Preferred name
- Methyl propenyl disulfide
- IUPAC
- (E)-1-(methyldisulfanyl)prop-1-ene
Names & synonyms
Methyl propenyl disulfideDisulfide, methyl 1-propenylMethyldithio-1-propeneDisulfide, methyl propenylMethyl 1-propenyl disulfideMethyl (E)-1-propenyl disulfideFEMA No. 3576Methyl trans-propenyl disulfideMethyl trans-1-propenyl disulfidetrans-1-Propenyl methyl disulfideDisulfide, methyl propenyl, (E)-23838-19-9
Show more names
Disulfide, methyl (1E)-1-propenylDisulfide, methyl 1-propenyl, (E)-METHYL PROP-1-ENYL DISULFIDEU35908447YMETHYL PROPENYL DISULFIDE [FHFI](E)-1-(methyldisulfanyl)prop-1-eneRefChem:8180581-(methyldisulfanyl)prop-1-ene
Database identifiers
- CAS
23838-19-9、5905-47-5- PubChem CID
- 5366552
- DTXSID
DTXSID901020620- UNII
- U35908447Y
- EC Number
- 227-605-4
- Nikkaji
- J132.894H、J517.011G
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 40.8
Experimental & physicochemical properties
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.955-0.961
Flavoring AgentsEU Flavoring substances
Solubility(in ethanol)
Boiling Point53-98 °C (14 mm Hg)
Refractive Index1.5415-1.5515
Physical Descriptioncolourless liquid
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P272, P280, P301+P317, P302+P352, P321, P330, P332+P317, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1375 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Disulfide, methyl 1-propenyl
Disulfide, methyl 1-propenyl: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Uses & manufacturing
Use Classification
Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
Flavoring Agents -> JECFA Flavorings Index
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…