Phosphorothioic acid, O,O-dimethyl S-(O',O'-dipropylphosphoramido)ethyl ester
Basic information
- CAS
23497-05-4- Standard SMILES
CCCOP(=O)(NCCSP(=O)(OC)OC)OCCC- InChIKey
KIVDJMSXOULQGV-UHFFFAOYSA-N- Molecular formula
- C10H25NO6P2S
- Average molar mass
- 349.32 g/mol
- Monoisotopic mass
- 349.08778269
Names & identifiers
- Preferred name
- Phosphorothioic acid, O,O-dimethyl S-(O',O'-dipropylphosphoramido)ethyl ester
- IUPAC
- 2-dimethoxyphosphorylsulfanyl-N-dipropoxyphosphorylethanamine
- English name
- Phosphorothioic acid S-[2-(dipropoxyphosphinylamino)ethyl]O,O-dimethyl ester
- Molecular formula
- C10H25NO6P2S
- Molecular weight
- 349.32
Names & synonyms
23497-05-4Phosphorothioic acid, O,O-dimethyl S-(O',O'-dipropylphosphoramido)ethyl esterPhosphoramidic acid, N-(O',O'-dimethylphosphorothio)ethyl-, O,O-dipropyl esterRefChem:371381s-{2-[(dipropoxyphosphoryl)amino]ethyl} o,o-dimethyl phosphorothioateDTXSID60946177Phosphorothioic acid S-[2-(dipropoxyphosphinylamino)ethyl]O,O-dimethyl esterPhosphoramidic acid, (2-mercaptoethyl)-, dipropyl ester, S-ester with O,O-dimethyl phosphorothioate (8CI)
Database identifiers
- CAS
23497-05-4- PubChem CID
- 90123
- DTXSID
DTXSID60946177- Nikkaji
- J50.472F
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 108 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 13
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 324
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Related reactions
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Compound notes
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