Grundinformationen
- Standard-SMILES
COC(OC)OC- InChIKey
PYOKUURKVVELLB-UHFFFAOYSA-N- Summenformel
- C4H10O3
- Durchschnittliche Molmasse
- 106,12 g/mol
- Monoisotopische Masse
- 106,06299418
Namen und Bezeichner
- Bevorzugter Name
- Trimethyl orthoformate
- IUPAC
- trimethoxymethane
- Lokaler Name
- Trimethylorthoformiat
- Englischer Name
- Trimethoxymethane
- Summenformel
- C4H10O3
- Molmasse
- 106.12
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
149-73-5- PubChem CID
- 9005
- DTXSID
DTXSID7027122- ChEMBL
CHEMBL3187679- UNII
- XAM28819YJ
- EC Number
- 205-745-7
- Nikkaji
- J8.664I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 0,2
- Polarare Oberfläche (TPSA)
- 27,7 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 3
- Schwere Atome
- 7
- Formalladung
- 0
- Komplexität
- 28,4
Experimentelle und physikochemische Eigenschaften
Density
0.9676 @ 20 °C/4 °C
0.9676 @ 20°C
Boiling Point
100.6 °C @ 760 MM HG
100.6 °C @760 [mm Hg]
Physical Description
Liquid
Colorless liquid with a pungent odor; [HSDB]
Physikochemische Eigenschaften
- Schmelzpunkt
- -53 °C · -53 °C
- Siedepunkt
- 101 · 101-102 °C(lit.)
- Dichte
- 0.97 g/mL · 0.97 g/mL at 25 °C(lit.)
- Dampfdichte
- 3.67 · 3.67 (vs air)
- Dampfdruck
- 23.5 mm · 23.5 mm Hg ( 20 °C)
- Brechungsindex
- 20 · n20/D 1.379(lit.)
- Flammpunkt
- 60 °F · 60 °F
- storage temp.
- 30 °C · Store below +30°C.
- Löslichkeit
- Miscible with ether, alcohol and benzene.
- Aggregatzustand
- Liquid
- Farbe
- Clear colorless
- Explosionsgrenze
- 1.4 · 1.4-44.6%(V)
- Wasserlöslichkeit
- 10 g/L · 10 g/L (hydrolysis)
- Merck
- 14 · 14,6884
- BRN
- 969215 · 969215
- Henry's Law Constant
- 6.9 · 6.9×10-1 mol/(m3Pa) at 25℃, Guthrie (1973)
- InChI
- 1S/C4H10O3/c1-5-4(6-2)7-3/h4H,1-3H3
- InChIKey
- PYOKUURKVVELLB-UHFFFAOYSA-N
- SMILES
- COC(OC)OC
- LogP
- -0.03 · -0.03-0.09 at 20℃
- CAS Datenbank
- 149 · 149-73-5(CAS DataBase Reference)
- NIST chemische Informationen
- Methane, trimethoxy-(149-73-5)
- EPA chemische Informationen
- Trimethoxymethane (149-73-5)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 0.7% (2 of 294) of reports.
Danger
H225 (99.3%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264+P265, P271, P280, P303+P361+P353, P304+P340, P305+P351+P338, P319, P337+P317, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 294 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
Gefahrenhinweise
Regulatory Information
Chemical: Methane, trimethoxy-
Methane, trimethoxy- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Methane, trimethoxy- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 08-09-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/12626
Trimethyl orthoformate: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
A skin, eye, and mucous membrane irritant; [HSDB] Findings in lethal dose animal experiments include cyanosis, loss of muscle tone, and unresponsiveness. [ToxPlanet: IUCLID] Hydrolyzed by water producing methanol; An irritant; [MSDSonline] See Methyl alcohol.
Hazard Classes and Categories
Flam. Liq. 2 (99.3%)
Flammable liquids - Category 2
Sicherheit und Schutzausrüstung
Protective Action Criteria (PAC)
12 [mg/m3]
130 [mg/m3]
790 [mg/m3]
Toxikologische Informationen
Sicherheitsdaten
- wgk
- 1
- tsca
- TSCA listed
- ridadr
- UN 3272 3/PG 2
- hs_code
- 29159080
- RTECS-Nr.
- RM6650000
- risk_code
- 11-36
- Toxizität
- LD50 orally in Rabbit: 3130 mg/kg
- hazard_code
- F,Xi
- safety_code
- 9-16-26-29
- hazard_class
- 3
- packing_group
- II
- Speicherklasse
- 3 - Flammable liquids
- Giftige Stoffe Daten
- 149-73-5(Hazardous Substances Data)
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 2STOT SE 3
- Selbstentzündungstemperatur
- 255 °C
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information
Pesticide, Fertilizer, and Other Agricultural Chemical Manufacturing
Methane, trimethoxy-: ACTIVE
Anwendungen
BeschreibungTrimethyl orthoformate is an effective solvent for thallium(III) nitrate-mediated oxidations. It undergoes acid catalyzed reaction with 6-(N-D-ribitylanilino) uracils to form 8-demethyl-8-hydroxy-5-deazariboflavins.
VerwendenTrimethyl Orthoformate is the most simple orthoester. Used in organic synthesis as a reagent for introducing a protecting group for aldehydes and in the creation of methoxymethylene groups and heterocyclic ring systems.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Anbieter50 Anbieter
Zugehörige Reaktionen
Verknüpfte Notizen
Wird geladen…