Dimethyl phosphonate

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Names

[ CAS No. ]:
868-85-9

[ Name ]:
Dimethyl phosphonate

[Synonym ]:
dimethyl H-phosphonate
Dimethylfosfit
Dimethyl phosphonate
dimethyl hydrogen phosphonate
Dimethylfosfonat
monomethyl methyl phosphonate
dimethylacidphosphite
phosphonic acid dimethyl ester
DIMETHYL PHOSPHITE
O,O-dimethyl phosphonate
(CH3O)2PHO
Phosphonic acid, dimethyl ester
Dimethylphosphit
EINECS 212-783-8
MFCD00044633

Chemical & Physical Properties

[ Density]:
1.2 g/mL at 25 °C(lit.)

[ Boiling Point ]:
170.5±0.0 °C at 760 mmHg

[ Molecular Formula ]:
C2H7O3P

[ Molecular Weight ]:
110.049

[ Flash Point ]:
29.4±0.0 °C

[ Exact Mass ]:
110.013283

[ PSA ]:
59.00000

[ LogP ]:
-1.31

[ Vapour Pressure ]:
1.9±0.3 mmHg at 25°C

[ Index of Refraction ]:
n20/D 1.402(lit.)

[ Stability ]:
Stable. Moisture sensitive. Incompatible with water, strong oxidizing agents, acid chlorides, strong bases.

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SZ7710000
CHEMICAL NAME :
Phosphonic acid, dimethyl ester
CAS REGISTRY NUMBER :
868-85-9
LAST UPDATED :
199710
DATA ITEMS CITED :
30
MOLECULAR FORMULA :
C2-H7-O3-P
MOLECULAR WEIGHT :
110.06
WISWESSER LINE NOTATION :
1OPHO&O1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration into the eye
SPECIES OBSERVED :
Rodent - rabbit
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
3040 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE :
Inhalation
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>20 gm/m3
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2970 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1831 mg/kg
TOXIC EFFECTS :
Autonomic Nervous System - other (direct) parasympathomimetic Lungs, Thorax, or Respiration - respiratory stimulation Gastrointestinal - changes in structure or function of salivary glands
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2610 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
2400 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - guinea pig
DOSE/DURATION :
900 mg/kg
TOXIC EFFECTS :
Autonomic Nervous System - other (direct) parasympathomimetic Lungs, Thorax, or Respiration - respiratory stimulation Gastrointestinal - changes in structure or function of salivary glands
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
7500 mg/kg/15D-I
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
26 gm/kg/13W-I
TOXIC EFFECTS :
Sense Organs and Special Senses (Eye) - corneal damage Nutritional and Gross Metabolic - weight loss or decreased weight gain Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
30 gm/kg/15D-I
TOXIC EFFECTS :
Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
97500 mg/kg/13W-I
TOXIC EFFECTS :
Lungs, Thorax, or Respiration - chronic pulmonary edema Related to Chronic Data - death
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
103 gm/kg/2Y-I
TOXIC EFFECTS :
Tumorigenic - Carcinogenic by RTECS criteria Lungs, Thorax, or Respiration - tumors Gastrointestinal - tumors
TYPE OF TEST :
Micronucleus test

MUTATION DATA

TYPE OF TEST :
Sister chromatid exchange
TEST SYSTEM :
Rodent - hamster Ovary
DOSE/DURATION :
250 mg/L
REFERENCE :
SCIEAS Science. (American Assoc. for the Advancement of Science, 1333 H St., NW, Washington, DC 20005) V.1- 1895- Volume(issue)/page/year: 236,933,1987 *** REVIEWS *** IARC Cancer Review:Animal Limited Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 48,85,1990 IARC Cancer Review:Group 3 IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man. (WHO Publications Centre USA, 49 Sheridan Ave., Albany, NY 12210) V.1- 1972- Volume(issue)/page/year: 48,85,1990 *** OCCUPATIONAL EXPOSURE LIMITS *** OEL-GERMANY;Carcinogen JAN 1993 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOHS - National Occupational Hazard Survey (1974) NOHS Hazard Code - 84136 No. of Facilities: 21 (estimated) No. of Industries: 1 No. of Occupations: 2 No. of Employees: 41 (estimated) NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - 84136 No. of Facilities: 7 (estimated) No. of Industries: 1 No. of Occupations: 1 No. of Employees: 1822 (estimated) No. of Female Employees: 272 (estimated)

Safety Information

[ Symbol ]:

GHS07, GHS08

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H317-H341-H351-H412

[ Precautionary Statements ]:
P273-P280

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn:Harmful

[ Risk Phrases ]:
R10;R21;R36

[ Safety Phrases ]:
S26-S36/37

[ RIDADR ]:
UN 3278 6.1/PG 3

[ WGK Germany ]:
1

[ RTECS ]:
SZ7710000

[ Packaging Group ]:
III

[ Hazard Class ]:
3.2

[ HS Code ]:
2920901300

Synthetic Route

Precursor & DownStream

Precursor

  • Methanol
  • methyl hydrogenphosphonate
  • Trimethyl phosphite
  • Phosphonic acid,P-benzoyl-, dimethyl ester
  • Trimethyl orthoformate
  • dimethyl n,n-diisopropylphosphoramidite
  • dimethyl [4-(diphenylmethylene)-1,4-dihydro-1-hydroxynaphthyl]phosphonate
  • Dichlorvos
  • tetraphosphorus octaoxide
  • trans-carbonyldichloro(dichlorophosphido)bis(triethylphospine)iridium(III)

DownStream

  • methyl 2-dimethoxyphosphoryloxy-3,3,3-trifluoropropanoate
  • (1-chloropropylideneamino) dimethyl phosphate
  • DIMETHYL (1-HYDROXY-1-METHYLETHYL)PHOSPHONATE
  • Dimethyl methylphosphonate
  • Metrifonate
  • DIMETHYL 2-ACETOXYETHYLPHOSPHONATE
  • dimethyl trimethylsilyl phosphite
  • 2-[(2-chlorophenyl)-dimethoxyphosphorylmethyl]propanedinitrile
  • (4-nitrophenyl)methyl 2-dimethoxyphosphoryl-2-hydroxyacetate

Customs

[ HS Code ]: 2920909090

[ Summary ]:
2920909090 esters of other inorganic acids of non-metals (excluding esters of hydrogen halides) and their salts; their halogenated, sulphonated, nitrated or nitrosated derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%

Articles

Does phosphoryl protonation occurs in aqueous phosphoesters solutions.

Spectrochim. Acta. A. Mol. Biomol. Spectrosc. 62(1-3) , 287-92, (2005)

Ionisation of trimethylphosphate (TMP), dimethylphosphate (DMP) and diethylphosphate (DEP) is investigated by acidic titration in water by Raman (R), Fourier transform infrared (FTIR) and nuclear magn...

Dealkylation of phosphonate esters with chlorotrimethylsilane.

Nucleosides Nucleotides Nucleic Acids 20(4-7) , 1299-302, (2001)

Chlorotrimethylsilane completely dealkylates phosphonate esters at elevated temperature in a sealed reaction vessel. These conditions are tolerated by a variety of functional groups and lead to high c...

Multidimensional analytical method based on binary phase shaping of femtosecond pulses.

J. Phys. Chem. A 109(11) , 2413-6, (2005)

Multidimensional chemical detection and identification based on phase shaped femtosecond laser pulses coupled to mass spectrometry is demonstrated. The method based on binary phase shaping (BPS) takes...


More Articles


Related Compounds

  • dimethyl phosphonate
  • acetyl dimethyl phosphonate
  • sodium dimethyl phosphonate
  • 2-Nitroethyl dimethyl phosphonate
  • (lithiomethyl)dimethyl phosphonate
  • TETRAMETHYLAMMONIUM DIMETHYL PHOSPHONATE
  • 1h-Indole-1-carboxylic acid,2-iodo-
  • 3-Bromoimidazo[1,2-a]pyrimidine-2-carboxamide
  • (5-Chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)methanol
  • Tert-butyl N-[2-(2-oxopropyl)cyclopentyl]carbamate
  • 1-(1-isopentylazetidin-3-yl)-1H-1,2,3-triazole-4-carboxylic acid
  • 6-methyl-N-{1-[5-(3-methyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]pyrrolidin-3-yl}nicotinamide
  • N-(1-Cyano-1-cyclopropylethyl)-2-(1-thia-4-azaspiro[5.5]undecan-4-yl)acetamide
  • N-[Cyano-(2,4-difluorophenyl)methyl]-4-(2-methyl-1,3-thiazol-4-yl)butanamide
  • 4-(Dibenzylamino)-2-methylbutan-2-ol
  • 3-bromo-N-butyl-2-nitroaniline
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