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Cas Database |
| Name |
Dimethylmorpholinophosphonate |
EINECS | N/A |
| CAS No. | 597-25-1 | Density | 1.21g/cm3 |
| PSA | 57.81000 | LogP | 0.65740 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C6H14 N O4 P | Boiling Point | 246.8°C at 760 mmHg |
| Molecular Weight | 195.155 | Flash Point | 103.1°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by intravenous route. Moderately toxic by ingestion and intraperitoneal routes. Questionable carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx and POx. See also ESTERS. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Phosphonicacid, 4-morpholinyl-, dimethyl ester (9CI); Phosphonic acid, morpholino-,dimethyl ester (6CI,7CI,8CI); Dimethyl morpholinophosphonate; Dimethylmorpholinophosphoramidate |
Article Data | 2 |
Dimethylmorpholinophosphonate Chemical Properties
Molecule structure of Dimethylmorpholinophosphonate (CAS NO.597-25-1) :
IUPAC Name: 4-dimethoxyphosphorylmorpholine
Molecular Weight: 195.153421 g/mol
Molecular Formula: C6H14NO4P
Density: 1.21 g/cm3
Boiling Point: 246.8 °C at 760 mmHg
Flash Point: 103.1 °C
Index of Refraction: 1.454
Molar Refractivity: 43.62 cm3
Molar Volume: 160.9 cm3
Polarizability: 17.29*10-24 cm3
Surface Tension: 37.8 dyne/cm
Enthalpy of Vaporization: 48.39 kJ/mol
Vapour Pressure: 0.0266 mmHg at 25 °C
XLogP3-AA: -0.7
H-Bond Acceptor: 5
Rotatable Bond Count: 3
Exact Mass: 195.066044
MonoIsotopic Mass: 195.066044
Topological Polar Surface Area: 48
Heavy Atom Count: 12
Complexity: 172
Canonical SMILES: COP(=O)(N1CCOCC1)OC
InChI: InChI=1S/C6H14NO4P/c1-9-12(8,10-2)7-3-5-11-6-4-7/h3-6H2,1-2H3
InChIKey: BZXUQIDKDGGYPB-UHFFFAOYSA-N
Dimethylmorpholinophosphonate Toxicity Data With Reference
| 1. | msc-mus:lym 2200 mg/L | NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. | ||
| 2. | cyt-ham:ovr 3 g/L | NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. | ||
| 3. | sce-ham:ovr 3 g/L | NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. | ||
| 4. | orl-rat LD50:6 g/kg | NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. | ||
| 5. | ipr-rat LD50:2400 mg/kg | NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. | ||
| 6. | ims-rat LD50:5200 mg/kg | NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. | ||
| 7. | orl-mus LD50:3300 mg/kg | NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. | ||
| 8. | ipr-mus LD50:5 g/kg | NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. | ||
| 9. | ivn-mus LD50:400 mg/kg | NTPTR* |
Dimethylmorpholinophosphonate Consensus Reports
NTP Carcinogenesis Studies (gavage); Some Evidence: rat NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. ; No Evidence: mouse NTPTR* National Toxicology Program Technical Report Series. (Research Triangle Park, NC 27709) No. NTP-TR-298 ,1986. .
Dimethylmorpholinophosphonate Safety Profile
Poison by intravenous route. Moderately toxic by ingestion and intraperitoneal routes. Questionable carcinogen with experimental carcinogenic data. Mutation data reported. When heated to decomposition it emits very toxic fumes of NOx and POx. See also ESTERS.
Dimethylmorpholinophosphonate Specification
Dimethylmorpholinophosphonate (CAS NO.597-25-1) is also called 4-27-00-00629 (Beilstein Handbook Reference) ; BRN 0141995 ; CCRIS 1352 ; Dimethyl 4-morpholinylphosphonate ; Dimethyl morpholinophosphoramidate ; HC 1717 ; HSDB 4195 ; Morpholinophosphonic acid dimethyl ester ; NCI-C54740 ; Phosphonic acid, 4-morpholinyl-, dimethyl ester ; Phosphonic acid, 4-morpholinyl-, dimethyl ester (9CI) ; Phosphonic acid, morpholino-, dimethyl ester . Dimethylmorpholinophosphonate (CAS NO.597-25-1) is clear colorless slightly viscous liquid. It is water soluble and slowly hydrolyzes upon exposure to moisture. Reactions Sensitive to prolonged exposure to air. When heated to decomposition Dimethylmorpholinophosphonate (CAS NO.597-25-1) emits very toxic fumes of nitrogen oxides and phosphorous oxides. Dimethylmorpholinophosphonate (CAS NO.597-25-1) is probably combustible.
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