Basic information
- Standard SMILES
CC(C)(C)c1ccc(OCC2CO2)cc1- InChIKey
HHRACYLRBOUBKM-UHFFFAOYSA-N- Molecular formula
- C13H18O2
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.13067982
Overview
P-tert-butylphenyl glycidyl ether is a clear light yellow liquid. (NTP, 1992)
Names & identifiers
- Preferred name
- p-tert-Butylphenyl glycidyl ether
- IUPAC
- 2-[(4-tert-butylphenoxy)methyl]oxirane
- English name
- ARALDITE M
- Molecular formula
- C13H18O2
- Molecular weight
- 206.28
Names & synonyms
Show more names
Database identifiers
- CAS
3101-60-8- PubChem CID
- 18360
- DTXSID
DTXSID1024702- ChEMBL
CHEMBL1890780- UNII
- DUA9665YBG
- EC Number
- 221-453-2、682-371-4
- Nikkaji
- J64.262B
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 21.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 199
Experimental & physicochemical properties
Physical Description
P-tert-butylphenyl glycidyl ether is a clear light yellow liquid. (NTP, 1992)
Liquid
Clear light yellow liquid; [CAMEO] Colorless liquid with a mild odor; [Sigma-Aldrich MSDS]
Physicochemical properties
- Boiling point
- 165 · 165-170 °C14 mm Hg(lit.)
- Density
- 1.038 g/mL · 1.038 g/mL at 25 °C(lit.)
- vapor pressure
- 0.025 Pa · 0.025Pa at 20℃
- refractive index
- 20 · n20/D 1.515(lit.)
- Flash point
- 215 °F · 215 °F
- storage temp.
- Inert atmosphere,Room Temperature
- form
- Liquid
- color
- Colorless to Almost colorless
- Water Solubility
- Slightly soluble in water.
- LogP
- 3.59 at · 3.59 at 20℃
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 9665 YBG · DUA9665YBG
- EPA Substance Registry System
- p-tert-Butylphenyl glycidyl ether (3101-60-8)
- UNSPSC Code
- 41116121 · 41116121
- NACRES
- 2 · MA.02
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H317-H319
- Precautionary statements
- 261 · P261-P280a-P305+P351+P338-P321-P333+P313-P501a
- Hazard Codes
- Xi,Xn,N,T
- Risk Statements
- 36 · 36/37/38-43-36/38-22-62-51/53-61
- Safety Statements
- 26 · 26-36/37/39-39-36-61-45-36/37-53
- WGK Germany
- 3 · 3
- RTECS
- 4250000 · TX4250000
- TSCA
- TSCA listed
- HS Code
- 2910.9 · 2910.90.2000
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 0.7% (7 of 1042) of reports.
Danger
H314 (44.7%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P261, P264, P264+P265, P272, P273, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P321, P332+P317, P333+P317, P337+P317, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1042 reports by companies from 16 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
Hazard information
Regulatory Information
Chemical: Oxirane, [[4-(1,1-dimethylethyl)phenoxy]methyl]-
Oxirane, 2-[[4-(1,1-dimethylethyl)phenoxy]methyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Oxirane, 2-[[4-(1,1-dimethylethyl)phenoxy]methyl]- 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)
TP - indicates a substance that is the subject of a proposed TSCA section 4 test rule.
Status: Active Update: 25-11-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/10438
Oxirane, 4-(1,1-dimethylethyl)phenoxymethyl-: Does not have an individual approval but may be used under an appropriate group standard
Reactivity Profile
P-TERT-BUTYLPHENYL 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
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. Insoluble in water.
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.
Nonfire Spill Response
SMALL SPILLS AND LEAKAGE: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with 60-70% ethanol followed by washing 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.
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
Safety data
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- TX4250000
- hs_code
- 2910.90.2000
- risk_code
- 36/37/38-43-36/38-22-62-51/53-61
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn,N,T
- safety_code
- 26-36/37/39-39-36-61-45-36/37-53
- Hazard statements
- H315-H317-H319
- REACH Registrations
- Active
- Precautionary statements
- P261-P280a-P305+P351+P338-P321-P333+P313-P501a
Chemistry & industry
Uses & manufacturing
General Manufacturing Information
Custom Compounding of Purchased Resins
Oxirane, 2-[[4-(1,1-dimethylethyl)phenoxy]methyl]-: ACTIVE
Applications
Uses4-tert-Butylphenyl glycidyl ether is used in paint industry and serves as organic coating in Paint, boat Paint, building coating material. It is also used as an epoxy reactive diluent.
General DescriptionClear light yellow liquid.
Upstream & downstream products
Downstream products
Suppliers50 total
Related reactions
Linked notes
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