4-tert-Butylcalix[8]arene - ≥98%(HPLC) , CAS No.68971-82-4

Name: 4-tert-Butylcalix[8]arene - ≥98%(HPLC) , CAS No.68971-82-4
Brand: Aladdin Scientific
SKU: T162640
Availability: InStock

CAS: 68971-82-4 Cat. No.: T162640 Peso molecular: 1297.86 Beilstein Registry Number: 2612050 Número EC: 627-780-0 PubChem CID: 434172

COA

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4-tert-Butylcalix[8]arene - ≥98%(HPLC) CAS No(68971-82-4) by Aladdin Scientific

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Disponible para pedir

GRADE & PURITY ≥98%(HPLC)

Synonyms

5,11,17,23,29,35,41,47-octa-tert-butylnonacyclo[43.3.1.1?,?.1?,??.1??,??.1??,??.1??,??.1??,??.1??,??]hexapentaconta-1(49),3,5,7(56),9,11,13(55),15(54),16,18,21,23,25(53),27,29,31(52),33,35,37(51),39(50),40,42,45,47-tetracosaen-49,50,51,52,53,54,55,56-octo

Storage

Room temperature

Shipped In

Normal

Specifications Nombres e identificadores Documentation Advanced Data Taxonomic Classification Estructura 3D Objetivos asociados (humanos) Objetivos asociados (no humanos) Mecanismos de acción Certificados (CoA, COO, BSE/TSE y tabla de análisis) Propiedades químicas y físicas Calculadoras de soluciones Reseñas

🧪

Why this grade

≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos

5, 11, 17, 23, 29, 35, 41, 47-octa-tert-butylnonacyclo[43.3.1.1?, ?.1?, ??.1??, ??.1??, ??.1??, ??.1??, ??.1??, ??]hexapentaconta-1(49), 3, 5, 7(56), 9, 11, 13(55), 15(54), 16, 18, 21, 23, 25(53), 27, 29, 31(52), 33, 35, 37(51), 39(50), 40, 42, 45, 47-tetracosaen-49, 50, 51, 52, 53, 54, 55, 56-octo

Especificaciones y pureza

≥98%(HPLC)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(HPLC)

Nombres e identificadores

Pubchem Sid	488189731
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488189731
Sonrisas canónicas	CC(C)(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=CC(=CC(=C5O)CC6=CC(=CC(=C6O)CC7=C(C(=CC(=C7)C(C)(C)C)CC8=C(C(=CC(=C8)C(C)(C)C)CC9=C(C(=CC(=C9)C(C)(C)C)C2)O)O)O)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)O
IUPAC Name	5,11,17,23,29,35,41,47-octatert-butylnonacyclo[43.3.1.13,7.19,13.115,19.121,25.127,31.133,37.139,43]hexapentaconta-1(48),3,5,7(56),9,11,13(55),15,17,19(54),21,23,25(53),27(52),28,30,33(51),34,36,39(50),40,42,45(49),46-tetracosaene-49,50,51,52,53,54,55,56-octol
InChIKey	OLZFZIXORGGLLS-UHFFFAOYSA-N
INCHI	1S/C88H112O8/c1-81(2,3)65-33-49-25-51-35-66(82(4,5)6)37-53(74(51)90)27-55-39-68(84(10,11)12)41-57(76(55)92)29-59-43-70(86(16,17)18)45-61(78(59)94)31-63-47-72(88(22,23)24)48-64(80(63)96)32-62-46-71(87(19,20)21)44-60(79(62)95)30-58-42-69(85(13,14)15)40-56(77(58)93)28-54-38-67(83(7,8)9)36-52(75(54)91)26-50(34-65)73(49)89/h33-48,89-96H,25-32H2,1-24H3
Isómeros SMILES	CC(C)(C)C1=CC2=C(C(=C1)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=CC(=CC(=C5O)CC6=CC(=CC(=C6O)CC7=C(C(=CC(=C7)C(C)(C)C)CC8=C(C(=CC(=C8)C(C)(C)C)CC9=C(C(=CC(=C9)C(C)(C)C)C2)O)O)O)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C)O
WGK Alemania	3
PubChem CID	434172
Peso molecular	1297.86
Beilstein	2612050
Reaxy-Rn	2612052

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids

Kingdom	Organic compounds
Superclass	Benzenoids
Clase	Not available
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzenoids
Alternative Parents	Organooxygen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	Benzenoid - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
Descripción	This compound belongs to the class of organic compounds known as benzenoids. These are aromatic compounds containing one or more benzene rings.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Estructura 3D

Objetivos asociados (humanos)

A498 (42825 Activities)

Lot Number	Certificate Type	Fecha	Articulo
J2424888	Certificate of Analysis	Jul 09, 2024	T162640
J2424889	Certificate of Analysis	Jul 09, 2024	T162640
F2517053	Certificate of Analysis	Jun 16, 2022	T162640
J2214617	Certificate of Analysis	Jun 16, 2022	T162640
J2214618	Certificate of Analysis	Jun 16, 2022	T162640
J2214619	Certificate of Analysis	Jun 16, 2022	T162640
J2214732	Certificate of Analysis	Jun 16, 2022	T162640
J2424011	Certificate of Analysis	Jun 16, 2022	T162640
J2517201	Certificate of Analysis	Jun 16, 2022	T162640
L2510049	Certificate of Analysis	Jun 16, 2022	T162640

Punto de fusión (°C)	411-412 °C
Peso molecular	1297.800 g/mol
XLogP3	25.900
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	8
Exact Mass	1296.84 Da
Monoisotopic Mass	1296.84 Da
Topological Polar Surface Area	162.000 Å²
Heavy Atom Count	96
Formal Charge	0
Complexity	1850.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1