Basic information
- CAS
108-25-8- Standard SMILES
CC(C)OC(=S)S- InChIKey
UOJYYXATTMQQNA-UHFFFAOYSA-N- Molecular formula
- C4H8OS2
- Average molar mass
- 136.2 g/mol
- Monoisotopic mass
- 136.00165722
Overview
Proxan is a thiocarbonyl compound.
Names & identifiers
- Preferred name
- Proxan
- IUPAC
- propan-2-yloxymethanedithioic acid
- English name
- O-isopropyl xanthate
- Molecular formula
- C4H8OS2
- Molecular weight
- 136.24
Names & synonyms
ProxanIsopropylxanthic acid108-25-8Proxan [ISO]isopropyl xanthateUNII-I25A065NOLCarbonodithioic acid, O-(1-methylethyl) esterI25A065NOLDTXSID6042076XANTHIC ACID, ISOPROPYL-NSC-274978CARBONIC ACID, DITHIO-, O-ISOPROPYL ESTER
Show more names
IPXISOPROPYLXANTHATEO-PROPAN-2-YL CARBONODITHIOATEDithiocarbonic acid O-isopropylDithiocarbonic acid O-isopropyl esterDithiocarbonic acid hydrogen O-isopropyl ester
RefChem:176739DTXCID4022076O-Isopropyl xanthatepropan-2-yloxymethanedithioic acidSCHEMBL134436CHEMBL3039754SCHEMBL10850846CHEBI:82248
Database identifiers
- CAS
108-25-8- PubChem CID
- 7919
- DTXSID
DTXSID6042076- ChEMBL
CHEMBL3039754- ChEBI
CHEBI:82248- UNII
- I25A065NOL
- Nikkaji
- J5.070I
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 42.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 70.1
Physicochemical properties
- Melting point
- 171 °C · 171 °C
- Boiling point
- 94 · 94-97 °C(Press: 1.8 Torr)
- Density
- 1.132 · 1.132±0.06 g/cm3(Predicted)
- pka
- 2.57 · 2.57±0.60(Predicted)
- FDA UNII
- 25 A065NOL · I25A065NOL
- EPA Substance Registry System
- Carbonodithioic acid, O-(1-methylethyl) ester (108-25-8)
Chemistry & industry
Suppliers1 total
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
Additional notes
DefinitionChEBI: Proxan is a thiocarbonyl compound.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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