Basic information
- CAS
7595-89-3- Standard SMILES
Cc1cccc(OP(=S)(S)Oc2cccc(C)c2)c1- InChIKey
GKNITEVWPONLFV-UHFFFAOYSA-N- Molecular formula
- C14H15O2PS2
- Average molar mass
- 310.4 g/mol
- Monoisotopic mass
- 310.02510906
Names & identifiers
- Preferred name
- Phosphorodithioic acid, O,O-di-m-tolyl ester
- IUPAC
- bis(3-methylphenoxy)-sulfanyl-sulfanylidene-λ5-phosphane
- English name
- Bis(3-methylphenyloxy)mercaptophosphine sulfide
- Molecular formula
- C14H15O2PS2
- Molecular weight
- 310.37
Names & synonyms
7595-89-3Phosphorodithioic acid, O,O-di-m-tolyl esterDTXSID10226855RefChem:1095442DTXCID40149346O,O'-Di-m-cresyl dithiophosphatePhosphorodithioic acid, O,O-bis(3-methylphenyl) esterNSC-402571NSC 402571BRN 2537433AI3-18974Phosphorothiolothionic acid, O,O-di-m-tolyl ester
Show more names
Dithiophosphoric acid O,O-di(m-tolyl) esterBis(3-methylphenyloxy)mercaptophosphine sulfideDithiophosphoric acid O,O-bis(3-methylphenyl) ester
o,o-bis(3-methylphenyl) hydrogen phosphorodithioateBis(3-methylphenoxy)-sulfanyl-sulfanylidene-lambda5-phosphaneW9CZU6M44A4-06-00-02058 (Beilstein Handbook Reference)WLN: 1R COPS&SHOR C1GKNITEVWPONLFV-UHFFFAOYSA-NNSC402571Phosphorodithioic acid,O-di-m-tolyl ester
Database identifiers
- CAS
7595-89-3- PubChem CID
- 82069
- DTXSID
DTXSID10226855- UNII
- W9CZU6M44A
- Nikkaji
- J50.443B
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 51.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 309
Physicochemical properties
- FDA UNII
- 9 CZU6M44A · W9CZU6M44A
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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