CAS 81475-22-1|4-tert-Butylcalix[5]arene

Introduction:Basic information about CAS 81475-22-1|4-tert-Butylcalix[5]arene, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name4-tert-Butylcalix[5]arene
CAS Number81475-22-1Molecular Weight811.141
Density1.1±0.1 g/cm3Boiling Point792.3±60.0 °C at 760 mmHg
Molecular FormulaC55H70O5Melting Point310-312ºC(lit.)
MSDS/Flash Point270.6±27.5 °C

Names

Name4-tert-Butylcalix[5]arene
SynonymMore Synonyms

Chemical & Physical Properties

Density1.1±0.1 g/cm3
Boiling Point792.3±60.0 °C at 760 mmHg
Melting Point310-312ºC(lit.)
Molecular FormulaC55H70O5
Molecular Weight811.141
Flash Point270.6±27.5 °C
Exact Mass810.522339
PSA101.15000
LogP15.16
Vapour Pressure0.0±2.9 mmHg at 25°C
Index of Refraction1.582
InChIKeyHTJNUHSOASZVHV-UHFFFAOYSA-N
SMILESCC(C)(C)c1cc2c(O)c(c1)Cc1cc(C(C)(C)C)cc(c1O)Cc1cc(C(C)(C)C)cc(c1O)Cc1cc(C(C)(C)C)cc(c1O)Cc1cc(C(C)(C)C)cc(c1O)C2

Safety Information

Safety Phrases22-24/25
WGK Germany3

Synonyms

para-tert-butylcalix[5]arene
5,11,17,23,29-pentakis(1,1-dimethylethyl)-35,36,37,38,39-pentahydroxycalix[5]arene
p-t-butylcalix[5]arene
MFCD00210028
Penta-tert-butyl(pentahydroxy)calix[5]arene
hexacyclo[25.3.1.1.1.1.1]pentatriaconta-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-pentadecaene-31,32,33,34,35-pentol, 5,11,17,23,29-pentakis(1,1-dimethylethyl)-
B2221
Hexacyclo[25.3.1.1.1.1.1]pentatriaconta-1(31),3,5,7(35),9,11,13(34),15,17,19(33),21,23,25(32),27,29-pentadecaene-31,32,33,34,35-pentol, 5,11,17,23,29-pentakis(1,1-dimethylethy
 l)-
5,11,17,23,29-Penta-tert-butylhexacyclo[25.3.1.1.1.1.1]pentatriaconta-1(31),3(35),4,6,9(34),10,12,15(33),16,18,21(32),22,24,27,29-pentadecaene-31,32,33,34,35-pentol
p-tert-butylcalix<5>arene
5,11,17,23,29-Pentakis(2-methyl-2-propanyl)hexacyclo[25.3.1.1.1.1.1]pentatriaconta-1(31),3(35),4,6,9(34),10,12,15(33),16,18,21(32),22,24,27,29-pentadecaene-31,32,33,34,35-pent &#xA;ol
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