Basic information
- CAS
1068-07-1- Standard SMILES
CCCCCCCCP(=O)(OCC)OCC- InChIKey
MVDVRXOWIPONFY-UHFFFAOYSA-N- Molecular formula
- C12H27O3P
- Average molar mass
- 250.31 g/mol
- Monoisotopic mass
- 250.16978172
Names & identifiers
- Preferred name
- Diethyl octylphosphonate
- IUPAC
- 1-diethoxyphosphoryloctane
- English name
- Diethyl 1-octylphosphonate
- Molecular formula
- C12H27O3P
- Molecular weight
- 250.31
Names & synonyms
Diethyl octylphosphonateEINECS 213-941-9AI3-18569RefChem:587253213-941-91068-07-1DIETHYL 1-OCTYLPHOSPHONATE1-diethoxyphosphoryloctanePhosphonic acid, octyl-, diethyl esteroctyl-phosphonic acid diethyl esterMFCD00015659Diethyl 1-octanephosphonate
Show more names
AURORA KA-1481Diethyl P-octylphosphonateDiethyl 1-octylphosphonate, 98+%1-octylphosphonic acid diethyl ester1-[ethoxy(octyl)phosphoryl]oxyethane
SCHEMBL503890AKOS017343273E81589diethyloctylphosphonateFT-0624817octyl-phosphonicaciddiethylesterDTXSID3074442MVDVRXOWIPONFY-UHFFFAOYSA-N
Database identifiers
- CAS
1068-07-1- PubChem CID
- 70604
- DTXSID
DTXSID3074442- EC Number
- 213-941-9
- Nikkaji
- J217.177E
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 185
Experimental & physicochemical properties
SpringerMaterials PropertiesDielectric constant
Physicochemical properties
- Boiling point
- 88 · 88-89°C 0,1mm
- Density
- 0 · 0,953 g/cm3
- refractive index
- 1.434 · 1.4340
- Flash point
- 88 · 88-89°C/0.1mm
- storage temp.
- Store at room temperature
- Appearance
- Colorless to light yellow Liquid
- Water Solubility
- 0.2 g/L · <0.2g/L(25 ºC)
- BRN
- 1778018 · 1778018
- EPA Substance Registry System
- Phosphonic acid, octyl-, diethyl ester (1068-07-1)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
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
This chemical does not meet GHS hazard criteria for 20% (1 of 5) of reports.
Warning
H315 (80%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 5 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Safety data
- risk_code
- 36/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280a-P305+P351+P338-P321-P332+P313-P337+P313
Chemistry & industry
Suppliers41 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
宁波万核化学科技有限公司+86-15827200700 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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