Basic information
- CAS
5301-65-5- Standard SMILES
CCOP(=O)(CC)OC- InChIKey
GYWPLJQMSDXQDK-UHFFFAOYSA-N- Molecular formula
- C5H13O3P
- Average molar mass
- 152.13 g/mol
- Monoisotopic mass
- 152.06023127
Names & identifiers
- Preferred name
- Ethyl methyl ethylphosphonate
- IUPAC
- 1-[ethyl(methoxy)phosphoryl]oxyethane
- English name
- Ethylphosphonic acid methylethyl ester
- Molecular formula
- C5H13O3P
- Molecular weight
- 152.13
Names & synonyms
Ethyl methyl ethylphosphonatePhosphonic acid, ethyl-, ethyl methyl esterDTXSID20967500RefChem:344882DTXCID701395097GYWPLJQMSDXQDK-UHFFFAOYSA-N5301-65-5SCHEMBL575693ETHYLPHOSPHONICACIDETHYLMETHYLESTEREthylphosphonic acid methylethyl esterPhosphonic acid, P-ethyl-, ethyl methyl ester
Database identifiers
- CAS
5301-65-5- PubChem CID
- 79183
- DTXSID
DTXSID20967500- EC Number
- 186-949-2
- Nikkaji
- J100.064K
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 113
Physicochemical properties
- Boiling point
- 78 · 78-79 °C(Press: 13 Torr)
- Density
- 1.028 · 1.028±0.06 g/cm3(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P317, P305+P354+P338, P317, P330, P391, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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