ChemicalBook--->CAS DataBase List--->96107-95-8

96107-95-8

96107-95-8 Structure

96107-95-8 Structure
IdentificationBack Directory
[Name]

CALIX[6]ARENE
[CAS]

96107-95-8
[Synonyms]

H 0713
AKOS 44
CALIX[6]ARENE
Calix(6)arene,99%
Calix6üarene, 99%
p-H-Calix[6]arene
Calix[6]arene 98%
Calix[6]arenehexol
HEXAHYDROXYCALIX[6]ARENE
CalixÄ6Üarene,99%
Calix[6]arene (contains ca. 5% Benzene)
37,38,39,40,41,42-HEXAHYDROXYCALIX[6]ARENE
Heptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3,5,7(42),9,11,13(41),15,17,19(40),21,23,25(39),27,29,31(38),33,35-octadecaene-37,38,39,40,41,42-hexol
[Molecular Formula]

C42H36O6
[MDL Number]

MFCD00143083
[MOL File]

96107-95-8.mol
[Molecular Weight]

636.73
Chemical PropertiesBack Directory
[Appearance]

white to beige powder
[Melting point ]

395 °C(lit.)
[Boiling point ]

630.34°C (rough estimate)
[density ]

1.302
[refractive index ]

1.6000 (estimate)
[form ]

powder to crystal
[pka]

9.20±0.20(Predicted)
[color ]

White to Light yellow
[Water Solubility ]

0.180g/100g of water @ 25°C. Miscible with alcohol, chloroform, ether, carbon disulfide, acetone, oils, carbon tetrachloride and glacial acetic acid.
[BRN ]

4345238
[InChIKey]

JLSWUKWFQCVKCL-UHFFFAOYSA-N
[SMILES]

C12=C(O)C(=CC=C1)CC1=C(O)C(=CC=C1)CC1=C(O)C(=CC=C1)CC1=C(O)C(=CC=C1)CC1=C(O)C(=CC=C1)CC1=C(O)C(=CC=C1)C2
[CAS DataBase Reference]

96107-95-8
Hazard InformationBack Directory
[Chemical Properties]

white to beige powder
[Uses]

It is used as a starting material for preparing functionalized calixarenes. It finds its uses as a pharmaceutical intermediate. It is also used in complexation and organic synthesis.
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

22-24/25
[WGK Germany ]

3
[HS Code ]

2907.29.9000
Spectrum DetailBack Directory
[Spectrum Detail]

CALIX[6]ARENE(96107-95-8)1HNMR
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