Basic information
- CAS
39004-94-9- Standard SMILES
COP(=S)(Oc1ccc([N+](=O)[O-])cc1)Oc1ccc([N+](=O)[O-])cc1- InChIKey
AQAXQJMWHPFBPU-UHFFFAOYSA-N- Molecular formula
- C13H11N2O7PS
- Average molar mass
- 370.28 g/mol
- Monoisotopic mass
- 370.00245887
Names & identifiers
- Preferred name
- Phosphorothioic acid, O,O-bis(p-nitrophenyl) O-methyl ester
- IUPAC
- methoxy-bis(4-nitrophenoxy)-sulfanylidene-λ5-phosphane
- English name
- Thiophosphoric acid O,O-bis(4-nitrophenyl)O-methyl ester
- Molecular formula
- C13H11N2O7PS
- Molecular weight
- 370.27
Names & synonyms
Bis-methylparathion [Czech]Bis-methylparathion39004-94-9Phosphorothioic acid, O,O-bis(p-nitrophenyl) O-methyl esterBRN 2546720O-Methyl-O,O-bis-(p-nitrofenyl)thiofosfat [Czech]O-Methyl-O,O-bis-(p-nitrofenyl)thiofosfatDTXSID30192280O,O-Bis-p-nitrofenyl-O-methylester kyseliny thiofosforecne [Czech]4-06-00-01340 (Beilstein Handbook Reference)O,O-Bis-p-nitrofenyl-O-methylester kyseliny thiofosforecneRefChem:371249
Show more names
Thiophosphoric acid O,O-bis(4-nitrophenyl)O-methyl esterPhosphorothioic acid, O-methyl O,O-bis(4-nitrophenyl) ester
DTXCID40114771O-methyl O,O-bis(4-nitrophenyl) phosphorothioate
Database identifiers
- CAS
39004-94-9- PubChem CID
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 151 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 454
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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