((Methylthio)methyl)oxirane
Basic information
- CAS
45378-62-9- Standard SMILES
CSCC1CO1- InChIKey
OSIXFNQHNPOVIA-UHFFFAOYSA-N- Molecular formula
- C4H8OS
- Average molar mass
- 104.17 g/mol
- Monoisotopic mass
- 104.02958605
Names & identifiers
- Preferred name
- ((Methylthio)methyl)oxirane
- IUPAC
- 2-(methylsulfanylmethyl)oxirane
- English name
- 1-Methylthio-2,3-epoxypropane
- Molecular formula
- C4H8OS
- Molecular weight
- 104.17
Names & synonyms
[(Methylthio)methyl]oxirane((Methylthio)methyl)oxiraneEINECS 256-238-2RefChem:390425256-238-245378-62-92-[(Methylsulfanyl)methyl]oxirane2-(methylsulfanylmethyl)oxirane2-((Methylthio)methyl)oxiraneNifuratel Impurity G1-methylthio-2,3-epoxypropaneNifuratel Impurity 10
Show more names
Nifuratel-3Nifuratel impurities2Nifuratel impurities480Methyl glycidyl thioetherMethylthiopropylene oxideNifuratel NFT2 IntermediateOxirane, 2-[(methylthio)methyl]-
Oxirane,2-[(methylthio)methyl]-SCHEMBL33911382,3-Epoxypropyl methyl sulfideOxirane, [(methylthio)methyl]-DTXSID909633772-[(Methylsulfanyl)methyl]oxirane #MFCD08703703AKOS010252188
Database identifiers
- CAS
45378-62-9- PubChem CID
- 548390
- DTXSID
DTXSID90963377- EC Number
- 256-238-2
- Nikkaji
- J591.249K
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 37.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 46.8
Physicochemical properties
- Symbol(GHS)
- 8 · GHS08,GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 311 · H311-H318-H315-H331-H350-H317-H361-H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501-P280-P302+P352-P312-P322-P361-P363-P405-P501-P201-P202-P281-P308+P313-P405-P501-P280-P305+P351+P338-P310-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P311-P321-P403+P233-P405-P501
- REACH Registrations
- Active
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P261, P262, P264, P264+P265, P270, P271, P272, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P316, P317, P318, P321, P330, P332+P317, P333+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Regulatory InformationREACH registered substance: [(methylthio)methyl]oxirane (EC: 256-238-2)
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS08,GHS05,GHS06
- Hazard statements
- H311-H318-H315-H331-H350-H317-H361-H301
- REACH Registrations
- Active
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501-P280-P302+P352-P312-P322-P361-P363-P405-P501-P201-P202-P281-P308+P313-P405-P501-P280-P305+P351+P338-P310-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P311-P321-P403+P233-P405-P501
Chemistry & industry
Applications
Uses2-[(Methylsulfanyl)methyl]oxirane is a garlic component and was useful for studying hydrogen peroxide scavenging.
Upstream & downstream products
Downstream products
Suppliers
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Related reactions
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Compound notes
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