Basic information
- CAS
4789-36-0- Standard SMILES
CCOP(O)(=S)CC- InChIKey
AIJQQTBLBLBZDI-UHFFFAOYSA-N- Molecular formula
- C4H11O2PS
- Average molar mass
- 154.17 g/mol
- Monoisotopic mass
- 154.02173776
Names & identifiers
- Preferred name
- O-Ethyl hydrogen P-ethylphosphonothioate
- IUPAC
- ethoxy-ethyl-hydroxy-sulfanylidene-λ5-phosphane
Names & synonyms
7776-66-1RefChem:1093643O-Ethyl hydrogen P-ethylphosphonothioateO-Ethyl ethylphosphonothioic acidO-Ethyl ethanephosphonothioic acidO-Ethyl ethylphosphonothioate5152-74-94789-36-0Ethyl ethylphosphonothioateO-Ethyl ethylthiophosphonateO-ethyl ethylphosphonothionatePhosphonothioic acid, ethyl-, O-ethyl ester
Show more names
Phosphonothioic acid, ethyl-, O-ethyl ester (S)-Phosphonothioic acid, ethyl-, O-ethyl ester, (R)-SCHEMBL2322349SCHEMBL13978281DTXSID30963957DTXSID801032979O-Ethyl O-hydrogen ethylphosphonothioateO-Ethyl hydrogen (R)-ethylphosphonothioate
Database identifiers
- CAS
4789-36-0、5152-74-9、7776-66-1- PubChem CID
- 197878
- DTXSID
DTXSID801032979
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 104
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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