Basic Description

Synonyms	AKOS000278332 \| Calix[6]arene (contains ca. 5% Benzene) \| Calix[6]arene, 97% \| LS-15438 \| T73102 \| W-204138 \| J-700385 \| Calix[6]arene \| DTXSID80369268 \| SCHEMBL2471777 \| SY102228 \| Hexahydroxycalix[6]arene \| Heptacyclo[31.3.1.13,7.19,13.115,19.121,25.127
Specifications & Purity	≥98%
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenols
    - Subclass 1-hydroxy-4-unsubstituted benzenoids

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenols
Subclass	1-hydroxy-4-unsubstituted benzenoids
Intermediate Tree Nodes	Not available
Direct Parent	1-hydroxy-4-unsubstituted benzenoids
Alternative Parents	Polyols Hydrocarbon derivatives
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	1-hydroxy-4-unsubstituted benzenoid - Polyol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as 1-hydroxy-4-unsubstituted benzenoids. These are phenols that are unsubstituted at the 4-position.
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

Names and Identifiers

Pubchem Sid	504760933
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504760933
IUPAC Name	heptacyclo[31.3.1.13,7.19,13.115,19.121,25.127,31]dotetraconta-1(37),3(42),4,6,9(41),10,12,15(40),16,18,21,23,25(39),27,29,31(38),33,35-octadecaene-37,38,39,40,41,42-hexol
INCHI	InChI=1S/C42H36O6/c43-37-25-7-1-8-26(37)20-28-10-3-12-30(39(28)45)22-32-14-5-16-34(41(32)47)24-36-18-6-17-35(42(36)48)23-33-15-4-13-31(40(33)46)21-29-11-2-9-27(19-25)38(29)44/h1-18,43-48H,19-24H2
InChIKey	JLSWUKWFQCVKCL-UHFFFAOYSA-N
Smiles	C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=CC=CC(=C5O)CC6=CC=CC(=C6O)CC7=CC=CC1=C7O)O)O)O
Isomeric SMILES	C1C2=C(C(=CC=C2)CC3=C(C(=CC=C3)CC4=C(C(=CC=C4)CC5=CC=CC(=C5O)CC6=CC=CC(=C6O)CC7=CC=CC1=C7O)O)O)O
WGK Germany	3
Molecular Weight	636.73
Beilstein	4345238
Reaxy-Rn	4345238
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4345238&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot Number	Certificate Type	Date	Item
F2417059	Certificate of Analysis	Jun 20, 2024	C101183
E2429019	Certificate of Analysis	Jun 03, 2024	C101183
F2425029	Certificate of Analysis	Jun 13, 2023	C101183
I2114105	Certificate of Analysis	Jun 13, 2023	C101183
I2114106	Certificate of Analysis	Jun 13, 2023	C101183
I2114107	Certificate of Analysis	Jun 13, 2023	C101183
H1930156	Certificate of Analysis	Mar 10, 2023	C101183
D1915013	Certificate of Analysis	Nov 10, 2022	C101183

Chemical and Physical Properties

Solubility	Miscible with alcohol, chloroform, ether, carbon disulfide, acetone, oils, carbon tetrachloride and glacial acetic acid.
Melt Point(°C)	395°C
Molecular Weight	636.700 g/mol
XLogP3	9.400
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	0
Exact Mass	636.251 Da
Monoisotopic Mass	636.251 Da
Topological Polar Surface Area	121.000 Å²
Heavy Atom Count	48
Formal Charge	0
Complexity	745.000
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

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Jiana Lin, Zenghui Xie, Yuling Hu, Gongke Li, Qisheng Zhong. (2024) Flower-like calix[6]arene-based covalent organic framework for membrane extraction of sulfonamides in animal-derived food through host-guest interaction prior to determination with ultra-high performance liquid chromatography-tandem mass spectrometry. JOURNAL OF CHROMATOGRAPHY A, 1713 (464499).

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SKU	Size	Availability	Price
C101183-1g	1g	3	$71.90
C101183-5g	5g	3	$243.90
C101183-25g	25g	2	$949.90

Calix[6]arene - 98%, high purity , CAS No.96107-95-8