15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol

Modify Date: 2024-01-09 10:18:50

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure
15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol structure
Common Name 15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol
CAS Number 122406-45-5 Molecular Weight 676.96600
Density 1.051g/cm3 Boiling Point 712.8ºC at 760mmHg
Molecular Formula C46H60O4 Melting Point N/A
MSDS N/A Flash Point 384.9ºC

 Names

Name 1,3-dimethoxy-4-tert-butylcalix(4)arene
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.051g/cm3
Boiling Point 712.8ºC at 760mmHg
Molecular Formula C46H60O4
Molecular Weight 676.96600
Flash Point 384.9ºC
Exact Mass 676.44900
PSA 58.92000
LogP 10.98160
Vapour Pressure 5.43E-21mmHg at 25°C
Index of Refraction 1.557

 MSDS

Name: 1,3-Dimethoxy-4-tert-butylcalix[4]arene, 99% (tlc) Material Safety Data Sheet
Synonym: None Known.
CAS: 122406-45-5
Section 1 - Chemical Product MSDS Name: 1,3-Dimethoxy-4-tert-butylcalix[4]arene, 99% (tlc) Material Safety Data Sheet
Synonym: None Known.
SECTION 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
122406-45-5 1,3-Dimethoxy-4-tert-butylcalix[4]aren 99 unlisted
+++++
Hazard Symbols: None Listed.
SECTION 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW The toxicological properties of this material have not been fully investigated. Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated. May be harmful if swallowed.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated. May be harmful if inhaled.
Chronic:
No information found.
SECTION 4 - FIRST AID MEASURES
Eyes:
In case of contact, immediately flush eyes with plenty of water for at least 15 minutes. Get medical aid.
Skin:
In case of contact, flush skin with plenty of water. Remove contaminated clothing and shoes. Get medical aid if irritation develops and persists. Wash clothing before reuse.
Ingestion:
If swallowed, do not induce vomiting unless directed to do so by medical personnel. Never give anything by mouth to an unconscious person. Get medical aid.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:
Treat symptomatically and supportively.
SECTION 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam.
SECTION 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions. Provide ventilation.
SECTION 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Use with adequate ventilation. Minimize dust generation and accumulation. Avoid breathing dust, vapor, mist, or gas. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
SECTION 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 122406-45-5: Personal Protective Equipment
Eyes:
Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.
SECTION 9 - PHYSICAL AND CHEMICAL PROPERTIES
Physical State: Powder
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C46H60O4
Molecular Weight: 676.97
SECTION 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not currently available.
Conditions to Avoid:
Dust generation.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported.
SECTION 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 122406-45-5 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
1,3-Dimethoxy-4-tert-butylcalix[4]arene - Not listed by ACGIH, IARC, or NTP.
SECTION 12 - ECOLOGICAL INFORMATION
SECTION 13 - DISPOSAL CONSIDERATIONS Dispose of in a manner consistent with federal, state, and local regulations.
SECTION 14 - TRANSPORT INFORMATION IATA
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing Group:
IMO
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing Group:
RID/ADR
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing group:


SECTION 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases: S 24/25 Avoid contact with skin and eyes. WGK (Water Danger/Protection) CAS# 122406-45-5: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 122406-45-5 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 122406-45-5 is not listed on the TSCA inventory. It is for research and development use only.
SECTION 16 - ADDITIONAL INFORMATION
MSDS Creation Date: 9/02/1997 Revision #3 Date: 2/18/2004 The information above is believed to be accurate and represents the best information currently available to us. However, we make no warranty of merchantability or any other warranty, express or implied, with respect to such information, and we assume no liability resulting from its use. Users should make their own investigations to determine the suitability of the information for their particular purposes. In no way shall the company be liable for any claims, losses, or damages of any third party or for lost profits or any special, indirect, incidental, consequential or exemplary damages, howsoever arising, even if the company has been advised of the possibility of such damages.

SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Safety Phrases S24/25

 Synthetic Route

~92%

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure

15,35,55,75-Tet...

CAS#:122406-45-5

Literature: Wang, Wen-Guang; Zheng, Qi-Yu; Huang, Zhi-Tang Synthetic Communications, 1999 , vol. 29, # 21 p. 3711 - 3718

~87%

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure

15,35,55,75-Tet...

CAS#:122406-45-5

Literature: Clainche, Loic Le; Giorgi, Michel; Reinaud, Olivia European Journal of Inorganic Chemistry, 2000 , # 9 p. 1931 - 1934

~69%

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure

15,35,55,75-Tet...

CAS#:122406-45-5

Literature: Tetrahedron Letters, , vol. 53, # 2 p. 141 - 144

~86%

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure

15,35,55,75-Tet...

CAS#:122406-45-5

Literature: Pitarch, Miguel; Browne, Julie K.; McKervey, M. Anthony Tetrahedron, 1997 , vol. 53, # 47 p. 16195 - 16204

~%

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure

15,35,55,75-Tet...

CAS#:122406-45-5

Literature: Tetrahedron Letters, , vol. 46, # 42 p. 7259 - 7262

~%

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure

15,35,55,75-Tet...

CAS#:122406-45-5

Literature: Tetrahedron Letters, , vol. 32, # 16 p. 1909 - 1912

~%

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure

15,35,55,75-Tet...

CAS#:122406-45-5

Literature: Tetrahedron Letters, , vol. 32, # 16 p. 1909 - 1912

~%

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure

15,35,55,75-Tet...

CAS#:122406-45-5

Literature: Supramolecular Chemistry, , vol. 22, # 4 p. 256 - 266

~%

15,35,55,75-Tetra-tert-butyl-32,72-dimethoxy-1,3,5,7(1,3)-tetrabenzenacyclooctaphane-12,52-diol Structure

15,35,55,75-Tet...

CAS#:122406-45-5

Literature: Tetrahedron, , vol. 39, # 3 p. 409 - 426

 Synonyms

5,11,17,23-tetra(tert-butyl)-25,27-dimethoxy-26,28-dihydroxycalix[4]arene
1,3-DIMETHOXY-4-TERT-BUTYLCALIX[4]ARENE
5,11,17,23-tetra-tert-butyl-25,27-dihydroxy-26,28-di(methyloxy)calix[4]arene
5,11,17,23-tetra-tert-butyl-25,27-dihydroxy-26,28-bis(methyloxy)calix[4]arenetitanium(IV) dichloride
5,11,17,23-tetra-tert-butyl-25,27-dihydroxy-26,28-dimethoxycalix[4]arene
24,26-dimethoxy-25,27-dihydroxy-5,11,17,23-tetra(4-tert-butyl)calix[4]arene
5,11,17,23-tetrakis(1,1-dimethylethyl)-25,27-dihydroxy-26,28-dimethoxycalix[4]arene
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