pinacolyl methylphosphonate
pinacolyl methylphosphonate structure
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Common Name | pinacolyl methylphosphonate | ||
|---|---|---|---|---|
| CAS Number | 616-52-4 | Molecular Weight | 180.18200 | |
| Density | 1.032 g/mL at 25ºC(lit.) | Boiling Point | 96-106ºC8 mm Hg(lit.) | |
| Molecular Formula | C7H17O3P | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 165 °F | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Summary: 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid (Pinacolyl methylphosphonate, CAS: 616-52-4), molecular formula C7H17O3P, molecular weight 180.18200. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.032 g/mL at 25ºC(lit.) |
|---|---|
| Boiling Point | 96-106ºC8 mm Hg(lit.) |
| Molecular Formula | C7H17O3P |
| Molecular Weight | 180.18200 |
| Flash Point | 165 °F |
| Exact Mass | 180.09200 |
| PSA | 56.34000 |
| LogP | 2.25280 |
| Index of Refraction | n20/D 1.434(lit.) |
| InChIKey | BLALDUPQYCGKAG-UHFFFAOYSA-N |
| SMILES | CC(OP(C)(=O)O)C(C)(C)C |
| Storage condition | ?20°C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H315-H319-H335 |
| Precautionary Statements | P261-P305 + P351 + P338 |
| Hazard Codes | Xi |
| Risk Phrases | 11-23/24/25-39/23/24/25-36/37/38 |
| Safety Phrases | 26-36 |
| RIDADR | NA 1993 / PGIII |
| WGK Germany | 3 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 0 | |
|---|---|
| DownStream 1 | |
![3-[methoxy(methyl)phosphoryl]oxy-2,2-dimethylbutane structure](https://image.chemsrc.com/caspic/298/7040-59-7.png)
CAS#:7040-59-7This table lists relevant public references with title, journal and publication metadata for this compound.
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On-line solid phase extraction-liquid chromatography-mass spectrometry for trace determination of nerve agent degradation products in water samples.
Anal. Chim. Acta 761 , 109-16, (2013) Three primary nerve agent degradation products (ethyl-, isopropyl- and pinacolyl methylphosphonic acid) have been determined in water samples using on-line solid phase extraction-liquid chromatography... |
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Capillary ion electrophoresis screening of nerve agent degradation products in environmental samples using conductivity detection.
J. Chromatogr. A. 824(1) , 125-34, (1998) A method of detecting signature methylphosphonic acid (MPA) breakdown products of V and G nerve agents in environmental samples was developed using capillary ion electrophoresis with conductivity dete... |
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On-line solid-phase extraction liquid chromatography-continuous flow frit fast atom bombardment mass spectrometric and tandem mass spectrometric determination of hydrolysis products of nerve agents alkyl methylphosphonic acids by p-bromophenacyl derivatization.
J. Chromatogr. A. 833(2) , 169-79, (1999) For proof of the presence of chemical warfare agents sarin, soman and VX, a rapid, accurate and sensitive method which allows us to determine their hydrolysis products ethyl methylphosphonic acid, iso... |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| pinacolyl hydrogen methylphosphonate |
| Pinacolyl methylphosphonic acid |
| 1,2,2-Trimethylpropyl hydrogen methylphosphonate |
| 1-methyl-2,2-dimethylpropyl methylphosphonic acid |
| O-1,2,2-trimethylpropyl methylphosphonic acid |
| Pinacolyl methylphosphonate |
| MFCD00192402 |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the safety information for 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid? |
| A: Safety information for 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid: 26-36. |
| Q: What are the downstream products of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid? |
| A: Related downstream products(CAS) of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid: 7040-59-7. |
| Q: What is the LogP of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid? |
| A: LogP of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid is 2.25280. |
| Q: What is the boiling point of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid? |
| A: Boiling point of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid is 96-106ºC8 mm Hg(lit.). |
| Q: What are the storage conditions for 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid? |
| A: Storage conditions for 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid: ?20°C. |
| Q: What is the polar surface area (PSA) of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid? |
| A: Polar surface area (PSA) of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid is 56.34000. |
| Q: What is the CAS number of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid? |
| A: CAS number of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid is 616-52-4. |
| Q: What is the InChIKey of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid? |
| A: InChIKey of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid is BLALDUPQYCGKAG-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid? |
| A: SMILES notation of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid is CC(OP(C)(=O)O)C(C)(C)C. |
| Q: What English synonyms does 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid have? |
| A: English synonyms of 3,3-dimethylbutan-2-yloxy(methyl)phosphinic acid: pinacolyl hydrogen methylphosphonate, Pinacolyl methylphosphonic acid, 1,2,2-Trimethylpropyl hydrogen methylphosphonate, 1-methyl-2,2-dimethylpropyl methylphosphonic acid, O-1,2,2-trimethylpropyl methylphosphonic acid, Pinacolyl methylphosphonate, MFCD00192402. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |