Basic information
- CAS
7665-72-7- Standard SMILES
CC(C)(C)OCC1CO1- InChIKey
SFJRUJUEMVAZLM-UHFFFAOYSA-N- Molecular formula
- C7H14O2
- Average molar mass
- 130.18 g/mol
- Monoisotopic mass
- 130.09937969
Names & identifiers
- Preferred name
- 2-((1,1-Dimethylethoxy)methyl)oxirane
- IUPAC
- 2-[(2-methylpropan-2-yl)oxymethyl]oxirane
- English name
- TERT-BUTYL GLYCIDYL ETHER
- Molecular formula
- C7H14O2
- Molecular weight
- 130.18
Names & synonyms
Show more names
Database identifiers
- CAS
7665-72-7- PubChem CID
- 24314
- DTXSID
DTXSID4024692- ChEMBL
CHEMBL1569413- UNII
- 35F8X83D0G
- EC Number
- 231-640-0
- Nikkaji
- J65.719K
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 21.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 93
Experimental & physicochemical properties
Flash Point
110 °F (NTP, 1992)
110 °F
Physical Description
T-butyl glycidyl ether is a clear colorless liquid. (NTP, 1992)
Clear liquid; [CAMEO]
Physicochemical properties
- Melting point
- -70 °C · -70°C
- Boiling point
- 150 · 150-152 °C
- Density
- 0.917 g/mL · 0.917 g/mL at 25 °C(lit.)
- vapor pressure
- 6.26 hPa · 6.26hPa at 25℃
- refractive index
- 20 · n20/D 1.417(lit.)
- Flash point
- 55 °C · 55°C
- form
- clear liquid
- color
- Colorless to Almost colorless
- Water Solubility
- 90.3 g/L · 90.3g/L at 20℃
- FreezingPoint
- -70 · -70
- BRN
- 103483 · 103483
- InChI
- 1S/C7H14O2/c1-7(2,3)9-5-6-4-8-6/h6H,4-5H2,1-3H3
- InChIKey
- SFJRUJUEMVAZLM-UHFFFAOYSA-N
- SMILES
- CC(C)(C)OCC1CO1
- LogP
- 0.97 at · 0.97 at 20℃
- CAS DataBase Reference
- 7665 · 7665-72-7(CAS DataBase Reference)
- FDA UNII
- 35 F8X83D0G · 35F8X83D0G
- EPA Substance Registry System
- tert-Butyl glycidyl ether (7665-72-7)
- UNSPSC Code
- 12162002 · 12162002
- NACRES
- 23 · NA.23
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Warning
- Hazard statements
- 226 · H226-H302-H317-H319
- Precautionary statements
- 210 · P210-P280-P301+P312+P330-P302+P352-P305+P351+P338
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xn
- Risk Statements
- 10 · 10-19-22-36-43
- Safety Statements
- 16 · 16-26-36/37
- RIDADR
- 3271 · UN 3271 3/PG 3
- WGK Germany
- 3 · 3
- RTECS
- 475000 · RR0475000
- F
- 9 · 9-21
- TSCA
- TSCA listed
- HazardClass
- 3.2 · 3.2
- PackingGroup
- III
- HS Code
- 29109000 · 29109000
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 4 OralEye · Acute Tox. 4 OralEye Irrit. 2Flam. Liq. 3Skin Sens. 1
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
Danger
H224 (20.5%): Extremely flammable liquid and vapor [Danger Flammable liquids];H226 (79.5%): Flammable liquid and vapor [Warning Flammable liquids];H302 (57.9%): Harmful if swallowed [Warning Acute toxicity, oral];H312 (20.5%): Harmful in contact with skin [Warning Acute toxicity, dermal];H315 (63%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (79.5%): May cause an allergic skin reaction [Warning Sensitization, Skin];H318 (41.7%): Causes serious eye damage [Danger Serious eye damage/eye irritation];H319 (58.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation];H332 (20.9%): Harmful if inhaled [Warning Acute toxicity, inhalation];H335 (62.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation];H341 (42.1%): Suspected of causing genetic defects [Warning Germ cell mutagenicity];H351 (42.1%): Suspected of causing cancer [Warning Carcinogenicity];H412 (63.8%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P203, P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P317, P318, P319, P321, P330, P332+P317, P333+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 254 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory Information
Chemical: Oxirane, [(1,1-dimethylethoxy)methyl]-
TP - indicates a substance that is the subject of a proposed TSCA section 4 test rule.
Status: Active Update: 04-12-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24489
Oxirane, (1,1-dimethylethoxy)methyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Reactivity Profile
T-BUTYL GLYCIDYL ETHER, an ether, can act as a base. They form salts with strong acids and addition complexes with Lewis acids. The complex between diethyl ether and boron trifluoride is an example. Ethers may react violently with strong oxidizing agents. In other reactions, which typically involve the breaking of the carbon-oxygen bond, ethers are relatively inert.
Air and Water Reactions
Highly flammable. Ethers tend to form unstable peroxides when exposed to oxygen. Ethyl, isobutyl, ethyl tert-butyl, and ethyl tert-pentyl ether are particularly hazardous in this respect. Ether peroxides can sometimes be observed as clear crystals deposited on containers or along the surface of the liquid. Water soluble.
Hazard Classes and Categories
Flam. Liq. 1 (20.5%);Flam. Liq. 3 (79.5%);Acute Tox. 4 (57.9%);Acute Tox. 4 (20.5%);Skin Irrit. 2 (63%);Skin Sens. 1 (79.5%);Eye Dam. 1 (41.7%);Eye Irrit. 2 (58.3%);Acute Tox. 3 (20.9%);STOT SE 3 (62.6%);Muta. 2 (42.1%);Carc. 2 (42.1%);Aquatic Chronic 3 (63.8%)
Acute toxicity - category 4;Skin irritation - category 2;Eye irritation - category 2A;Skin sensitisation - category 1;Germ cell mutagenicity - category 2;Carcinogenicity - category 2;Reproductive toxicity - category 2;Specific target organ toxicity (single exposure) - category 3
Safety & protection
First Aid
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.;SKIN: IMMEDIATELY flood affected skin with water while removing and isolating all contaminated clothing. Gently wash all affected skin areas thoroughly with soap and water. If symptoms such as redness or irritation develop, IMMEDIATELY call a physician and be prepared to transport the victim to a hospital for treatment.;INHALATION: IMMEDIATELY leave the contaminated area; take deep breaths of fresh air. If symptoms (such as wheezing, coughing, shortness of breath, or burning in the mouth, throat, or chest) develop, call a physician and be prepared to transport the victim to a hospital. Provide proper respiratory protection to rescuers entering an unknown atmosphere. Whenever possible, Self-Contained Breathing Apparatus (SCBA) should be used; if not available, use a level of protection greater than or equal to that advised under Protective Clothing.;INGESTION: DO NOT INDUCE VOMITING. If the victim is conscious and not convulsing, give 1 or 2 glasses of water to dilute the chemical and IMMEDIATELY call a hospital or poison control center. Be prepared to transport the victim to a hospital if advised by a physician. If the victim is convulsing or unconscious, do not give anything by mouth, ensure that the victim's airway is open and lay the victim on his/her side with the head lower than the body. DO NOT INDUCE VOMITING. IMMEDIATELY transport the victim to a hospital. (NTP, 1992)
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If you should spill this chemical, use absorbent paper to pick up all liquid spill material. Seal the absorbent paper, as well as any of your clothing which may be contaminated, in a vapor-tight plastic bag for eventual disposal. Wash any surfaces you may have contaminated with a soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned.;STORAGE PRECAUTIONS: You should store this material in a refrigerator. STORE AWAY FROM SOURCES OF IGNITION. (NTP, 1992)
Isolation and Evacuation
Excerpt from ERG Guide 127 [Flammable Liquids (Water-Miscible)]:;IMMEDIATE PRECAUTIONARY MEASURE: Isolate spill or leak area for at least 50 meters (150 feet) in all directions.;LARGE SPILL: Consider initial downwind evacuation for at least 300 meters (1000 feet).;FIRE: If tank, rail tank car or highway tank is involved in a fire, ISOLATE for 800 meters (1/2 mile) in all directions; also, consider initial evacuation for 800 meters (1/2 mile) in all directions. (ERG, 2024)
Personal Protective Equipment (PPE)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)
Toxicology
Regulatory information
Regulatory Information
Chemical: Oxirane, [(1,1-dimethylethoxy)methyl]-
TP - indicates a substance that is the subject of a proposed TSCA section 4 test rule.
Status: Active Update: 04-12-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/24489
Oxirane, (1,1-dimethylethoxy)methyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Safety data
- F
- 9-21
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- RR0475000
- ridadr
- UN 3271 3/PG 3
- hs_code
- 29109000
- risk_code
- 10-19-22-36-43
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- Xn
- safety_code
- 16-26-36/37
- hazard_class
- 3.2
- Storage Class
- 3 - Flammable liquids
- packing_group
- III
- Hazard statements
- H226-H302-H317-H319
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 4 OralEye Irrit. 2Flam. Liq. 3Skin Sens. 1
- Precautionary statements
- P210-P280-P301+P312+P330-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
Applications
UsesTERT-BUTYL GLYCIDYL ETHER is used as an active diluent.
General DescriptionClear colorless liquid.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers77 total
Related reactions
Compound notes
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