Basic information
- CAS
24332-20-5- Standard SMILES
COCC(OC)OC- InChIKey
DYOZNCVZPFIXLU-UHFFFAOYSA-N- Molecular formula
- C5H12O3
- Average molar mass
- 120.15 g/mol
- Monoisotopic mass
- 120.07864424
Names & identifiers
- Preferred name
- 1,1,2-Trimethoxyethane
- IUPAC
- 1,1,2-trimethoxyethane
- English name
- 1,1,2-Trimethoxyethane
- Molecular formula
- C5H12O3
- Molecular weight
- 120.15
Names & synonyms
Show more names
Database identifiers
- CAS
24332-20-5- PubChem CID
- 47520
- DTXSID
DTXSID50179073- UNII
- 682PCN62W8
- EC Number
- 246-175-9
- Nikkaji
- J121.205B
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 42.9
Experimental & physicochemical properties
Physicochemical properties
- Boiling point
- 56 · 56-59 °C56 mm Hg(lit.)
- Density
- 0.932 g/mL · 0.932 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.392(lit.)
- Flash point
- 74 °F · 74 °F
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- form
- clear liquid
- color
- Colorless to Almost colorless
- Specific Gravity
- 0.96 · 0.96
- BRN
- 741876 · 741876
- InChI
- 1S/C5H12O3/c1-6-4-5(7-2)8-3/h5H,4H2,1-3H3
- InChIKey
- DYOZNCVZPFIXLU-UHFFFAOYSA-N
- SMILES
- COCC(OC)OC
- CAS DataBase Reference
- 24332 · 24332-20-5(CAS DataBase Reference)
- FDA UNII
- 682 PCN62W8 · 682PCN62W8
- NIST Chemistry Reference
- 1 · Ethane, 1,1,2-trimethoxy-(24332-20-5)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Warning
- Hazard statements
- 226 · H226-H315-H319-H335
- Precautionary statements
- 210 · P210-P233-P240-P241-P303+P361+P353-P305+P351+P338
- target organs
- Respiratory system
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi
- Risk Statements
- 10 · 10-36/37/38
- Safety Statements
- 26 · 26-36
- RIDADR
- 3271 · UN 3271 3/PG 3
- WGK Germany
- 3 · 3
- HazardClass
- 3.2 · 3.2
- PackingGroup
- III
- HS Code
- 29110000 · 29110000
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 2 Flam · Eye Irrit. 2Flam. Liq. 2STOT SE 3
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Safety & regulation
GHS classification
GHS Classification
Warning
H226 (95.3%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Ethane, 1,1,2-trimethoxy-
1,1,2-Trimethoxyethane: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- ridadr
- UN 3271 3/PG 3
- hs_code
- 29110000
- risk_code
- 10-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- hazard_class
- 3.2
- Storage Class
- 3 - Flammable liquids
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H226-H315-H319-H335
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 2STOT SE 3
- Precautionary statements
- P210-P233-P240-P241-P303+P361+P353-P305+P351+P338
Chemistry & industry
Applications
UsesMethoxyacetaldehyde Dimethyl Acetal is a reagent used in balancing oral exposure with Cyp3A4 inhibition in benzimidazole-based IGF-1R inhibitors.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Related reactions
Compound notes
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