CAS Number15054-86-1
SynonymsEINECS 203-473-3; 1,2-Ethane-d-diol-d; MFCD00002885; Ethylene glycol-d6; (H)Ethane-1,2-(H)diol; 1,2-(H)Ethane(H)diol; 1,1,2,2-tetradeuterio-1,2-dideuteriooxyethane
Molecular FormulaDOCD2CD2OD
Molecular Weight68.10
Density1.1±0.1 g/cm3
Boiling Point197.5±0.0 °C at 760 mmHg
Melting Point-13ºC(lit.)
AppearanceTransparent colorless liquid
EINECS239-122-6
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 15054-86-1 |
| Catalog No. | 2A-1190089 |
| Chinese Name | 氘代乙二醇 |
| Synonyms | EINECS 203-473-3; 1,2-Ethane-d-diol-d; MFCD00002885; Ethylene glycol-d6; (H)Ethane-1,2-(H)diol; 1,2-(H)Ethane(H)diol; 1,1,2,2-tetradeuterio-1,2-dideuteriooxyethane |
| Molecular Formula | DOCD2CD2OD |
| Molecular Weight | 68.10 |
| Density | 1.1±0.1 g/cm3 |
| Boiling Point | 197.5±0.0 °C at 760 mmHg |
| Melting Point | -13ºC(lit.) |
| Appearance | Transparent colorless liquid |
| Storage Condition | Sealed at room temperature, protected from light, |
| Application | Ethylene glycol-d6 is deuterium labeled ethylene glycol [1]. |
| EINECS | 239-122-6 |
| PubChem ID | 24877757 |
| MDL Number | MFCD00078666 |
| SMILES | OCCO |
| InChI | InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2/i1D2,2D2,3D,4D |
| InChI Key | LYCAIKOWRPUZTN-UFSLNRCZSA-N |
| NACRES Code | NA.21 |
| UNSPSC | 12142201 |
| Hazard Symbols | transportation |
| Bioactivity | Ethylene Glycol-d6 is the deuterium labeled Ethylene glycol[1]. Related Catalog Research Areas >> Others In Vitro Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1]. References [1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216. Chemical & Physical Properties Density 1.1±0.1 g/cm3 Boiling Point 197.5±0.0 °C at 760 mmHg Melting Point -13ºC(lit.) Molecular Formula C2H6O2 Molecular Weight 68.105 Flash Point 108.2±13.0 °C Exact Mass 68.074440 PSA 40.46000 LogP -1.69 Vapour density 2.1 (vs air) Vapour Pressure 0.1±0.8 mmHg at 25°C Index of Refraction 1.422 InChIKey LYCAIKOWRPUZTN-UFSLNRCZSA-N SMILES OCCO Storage condition 2-8°C |
| Use of | Ethylene Glycol-d6 is the deuterium labeled Ethylene glycol[1]. Properties Name Ethylene Glycol-d (Isotopic) Synonym More Synonyms 1,2-(2H4)Ethane(2H2)diol Biological Activity Description Ethylene Glycol-d6 is the deuterium labeled Ethylene glycol[1]. Related Catalog Research Areas >> Others In Vitro Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs[1]. References [1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-216. Chemical & Physical Properties Molecular Formula C2H6O2 Exact Mass 68.074440 PSA 40.46000 LogP -1.69 Vapour density 2.1 (vs air) Index of Refraction 1.422 InChIKey LYCAIKOWRPUZTN-UFSLNRCZSA-N SMILES OCCO |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available |
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| ACETIC ACID-D | 758-12-3 | 2A-1190090 |
| ACETONITRILE-D3 | 2206-26-0 | 2A-1190092 |
| DEUTERIUM CHLORIDE | 7698-05-7 | 2A-1190095 |
| MESITYLENE-D12 | 69441-16-3 | 2A-1190096 |
| DIMETHYL-D6 SULFATE | 15199-43-6 | 2A-1190097 |
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