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Diisopropyl methylphosphonate

CAS 1445-75-6C7H17O3PMW 180.18

Diisopropyl methylphosphonate (CAS 1445-75-6) — formula C7H17O3P, molecular weight 180.18; category organic chemicals.

Specifications

CAS Number1445-75-6
Molecular FormulaC7H17O3P
Molecular Weight180.18
Boiling Point121.05 °C @ 10 mm Hg
LogPlog Kow= 1.03
ApplicationsUses: A byproduct from the manufacture of the nerve-agent Sarin (constitutes up to 20% of Sarin), [HSDB], May be used to simulate G-type chemical agents, General Manufacturing Information: Phosphonic acid, P-methyl-, bis(1-methylethyl) ester: ACTIVE, Diisopropyl methylphosphonate is a byproduct from the manufacture of the nerve-agent Sarin, Constitutes up to 20% of Sarin
CategoryOrganic Chemicals

Where it is used

Documented applications: Uses: A byproduct from the manufacture of the nerve-agent Sarin (constitutes up to 20% of Sarin), [HSDB], May be used to simulate G-type chemical agents, General Manufacturing Information: Phosphonic acid, P-methyl-, bis(1-methylethyl) ester: ACTIVE, Diisopropyl methylphosphonate is a byproduct from the manufacture of the nerve-agent Sarin, Constitutes up to 20% of Sarin.

Purchase Profile

What this product is

Diisopropyl methylphosphonate is a carbon-based organic compound with CAS registry number 1445-75-6 and molecular formula C7H17O3P (molecular weight 180.18), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 1445-75-6

Its molecular formula C7H17O3P comprises 7 C, 17 H, 3 O, 1 P atoms.

Also known as: Diisopropyl methylphosphonate · Diisopropyl methanephosphonate

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of Diisopropyl methylphosphonate?

The CAS registry number of Diisopropyl methylphosphonate is 1445-75-6.

What is the molecular formula and molecular weight of Diisopropyl methylphosphonate?

Molecular formula C7H17O3P, molecular weight 180.18.

What other names is Diisopropyl methylphosphonate known by?

It is also registered under: Diisopropyl methylphosphonate, Diisopropyl methanephosphonate.

What are the documented applications of Diisopropyl methylphosphonate?

Recorded applications: Uses: A byproduct from the manufacture of the nerve-agent Sarin (constitutes up to 20% of Sarin), [HSDB], May be used to simulate G-type chemical agents, General Manufacturing Information: Phosphonic acid, P-methyl-, bis(1-methylethyl) ester: ACTIVE, Diisopropyl methylphosphonate is a byproduct from the manufacture of the nerve-agent Sarin, Constitutes up to 20% of Sarin.

Which category does Diisopropyl methylphosphonate belong to?

Category: Organic Chemicals.

PubChem Public Data

Public-database records for Diisopropyl methylphosphonate (CAS 1445-75-6), reproduced here for independent cross-checking.

Safety classification and hazard statements

Reported hazard statementsH302 (100%), H319 (51.9%)

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

H319 (51.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

Physical description and handling notes

  • Colorless liquid; [MSDSonline]
  • Water solubility = 160 g/L at 25 °C
  • Vapor pressure = 0.17 mmHg at 25 °C
  • Vapor pressure= 0.267 kPa at 70 °C
  • 28.8 dynes/cm

Reported physical properties

沸点121.05 °C @ 10 mm Hg
沸点121.05 °C @760 [mm Hg]
溶解度In water, 1.50X10+3 mg/l @ 25 °C
密度0.976
密度0.976 No temp
蒸气压0.28 [mmHg]
蒸气压0.28 mm Hg @ 25 °C
蒸气压0.28 [mm Hg] @25 °C
LogPlog Kow= 1.03
LogP1.03

How this substance is indexed

CAS Registry Number1445-75-6
PubChem CID3073
分子式C7H17O3P
IUPAC 名称2-[methyl(propan-2-yloxy)phosphoryl]oxypropane
UNII(FDA)56V3OG5DC7

Documented uses

  • A byproduct from the manufacture of the nerve-agent Sarin (constitutes up to 20% of Sarin); [HSDB]
  • May be used to simulate G-type chemical agents
  • Phosphonic acid, P-methyl-, bis(1-methylethyl) ester: ACTIVE
  • Diisopropyl methylphosphonate is a byproduct from the manufacture of the nerve-agent Sarin
  • ... Three dose levels of diisopropyl methylphosphonate were applied to a shaved area on the backs of Yorkshire-Cross pigs: 400, 40, and 4 ug/sq cm. Additional animals were given 40 mg of diisopropyl methylphosphonate by sc injection, which was equivalent to the high dose applied dermally. Within 24 hr of injection, 91% of the sc administered dose was eliminated in the urine. After 5 days, no further amt was detected in the urine. All tissue specimens collected revealed less than 0.04 ug/g of tissue. For those pigs
  • Single doses (225 mg/kg) of [14C]-radiolabeled diisopropyl methylphosphonate dissolved in polyethylene glycol were admin by gavage to fasted male mice, rats, and dogs ... In mice, the highest level of radioactivity (172 ug/ml) was noted in the blood at 15 min. In rats, plasma concn peaked at 151 ug/ml about 2 hr after cmpd admin ... In dogs, peak plasma concn also occurred at 2 hr post-admin at a concn of 276 ug/ml ... Approx 90% of the diisopropyl methylphosphonate was absorbed from the GI tract. This estimate is

Names this substance appears under

DIISOPROPYL METHYLPHOSPHONATE; 1445-75-6; Diisopropyl methanephosphonate; Bis(1-methylethyl) methylphosphonate; DTXSID5024051; Methylphosphonic acid bis(1-methylethyl)ester; 56V3OG5DC7; Phosphonic acid, methyl-, bis(1-methylethyl) ester; DTXCID304051; CHEBI:77325; Diisopropyl methylphosphonate (DIMP); RefChem:587905; 215-896-0; METHYLPHOSPHONIC ACID DIISOPROPYL ESTER; 2-[methyl(propan-2-yloxy)phosphoryl]oxypropane; MFCD00015022

Computed molecular descriptors

分子量180.18
XLogP30.6
氢键供体数0
氢键受体数3
可旋转键数4
精确质量180.09153140
单同位素质量180.09153140
拓扑极性表面积35.5
重原子数11
形式电荷0

Database abstract

Diisopropyl methylphosphonate · CAS 1445-75-6 · C7H17O3P. UNII 56V3OG5DC7. 沸点: 121.05 °C @ 10 mm Hg; 沸点: 121.05 °C @760 [mm Hg]; 溶解度: In water, 1.50X10+3 mg/l @ 25 °C.

Source: PubChem / Wikidata; the batch COA governs where values differ.

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