Ent 27082
Basic information
- CAS
18300-07-7- Standard SMILES
CCP(=S)(OC)SCSCSP(=S)(CC)OC- InChIKey
IPDFCGAQJIOBPK-UHFFFAOYSA-N- Molecular formula
- C8H20O2P2S5
- Average molar mass
- 370.5 g/mol
- Monoisotopic mass
- 369.95420974
Names & identifiers
- Preferred name
- Ent 27082
- IUPAC
- ethyl-[[ethyl(methoxy)phosphinothioyl]sulfanylmethylsulfanylmethylsulfanyl]-methoxy-sulfanylidene-λ5-phosphane
- English name
- Thiobis(methylenethio)bis[ethylphosphinothioic acid O-methyl] ester
- Molecular formula
- C8H20O2P2S5
- Molecular weight
- 370.52
Names & synonyms
Stauffer N-373518300-07-7N 3735ENT 27,082BRN 1984087AI3-27082ENT 27082S,S'-(Thiodimethylene) O,O'-dimethyl bis(ethylphosphonodithioate)Phosphonodithioic acid, ethyl-, S,S'-(thiodimethylene) O,O'-dimethyl esterPhosphonodithioic acid, ethyl-, S,S'-(thiobis(methylene)) O,O'-dimethyl esterPhosphonodithioic acid, ethyl-, O-methyl ester, S,S-diester with thiodimethanethiolRefChem:339604
Show more names
N-3735Phosphonodithioic acid, ethyl-, S,S'-[thiobis(methylene)] O,O'-dimethyl ester (9CI)
Phosphonodithioic acid, ethyl-, O-methyl ester, S,S-diester with thiodimethanethiol (7CI)Phosphonodithioic acid, ethyl-, S,S'-(thiobis(methylene)) O,O'-dimethyl ester (9CI)Thiobis(methylenethio)bis[ethylphosphinothioic acid O-methyl] esterEthyl-[[ethyl(methoxy)phosphinothioyl]sulfanylmethylsulfanylmethylsulfanyl]-methoxy-sulfanylidene-lambda5-phosphaneDTXSID40939668O,O'-Dimethyl S,S'-[sulfanediylbis(methylene)] bis[ethyl(phosphonodithioate)]
Database identifiers
- CAS
18300-07-7- PubChem CID
- 87566
- DTXSID
DTXSID40939668- Nikkaji
- J15.436I
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 159 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 272
Physicochemical properties
- Boiling point
- 412 · 412.0±55.0 °C(Predicted)
- Density
- 1.326 · 1.326±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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