CAS 29471-17-8|4',4''(5'')-DI-TERT-BUTYLDIBENZO-18-CROWN-6

Introduction：Basic information about CAS 29471-17-8|4',4''(5'')-DI-TERT-BUTYLDIBENZO-18-CROWN-6, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.

Table of Contents

1. Names
2. BiologicalActivity
3. Chemical & Physical Properties
4. Toxicological Information
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
5. Safety Information
6. Synonyms

Common Name	4',4''(5'')-DI-TERT-BUTYLDIBENZO-18-CROWN-6
CAS Number	29471-17-8	Molecular Weight	424.57
Density	1.03g/cm3	Boiling Point	567.2ºC at 760 mmHg
Molecular Formula	C₂₄H₄₀O₆	Melting Point	112-116ºC
MSDS	/	Flash Point	216.5ºC

Names

Name	4',4''(5'')-di-tert-butyldibenzo-18-crown-6
Synonym	More Synonyms

BiologicalActivity

Description	4',4''(5'')-Di-tert-butyldibenzo-18-crown-6 is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
Related Catalog	Research Areas >>Others

Chemical & Physical Properties

Density	1.03g/cm3
Boiling Point	567.2ºC at 760 mmHg
Melting Point	112-116ºC
Molecular Formula	C₂₄H₄₀O₆
Molecular Weight	424.57
Flash Point	216.5ºC
Exact Mass	472.28200
PSA	55.38000
LogP	5.54380
Vapour Pressure	2.7E-12mmHg at 25°C
Index of Refraction	1.489
InChIKey	ODEWVZWKIFSVMI-UHFFFAOYSA-N
SMILES	CC(C)(C)c1ccc2c(c1)OCCOCCOc1ccc(C(C)(C)C)cc1OCCOCCO2

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: HP5386500

CHEMICAL NAME :: Dibenzo(b,k)(1,4,7,10,13,16)hexaoxacyclooctadecin, 6,7,9,10,17,18,20,21-octahydro- 2,13(or 2,14)-bis(1,1-dimethylethyl)-

CAS REGISTRY NUMBER :: 29471-17-8

LAST UPDATED :: 199109

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C28-H40-O6

MOLECULAR WEIGHT :: 472.68

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 35 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 23,402,1989

Safety Information

Hazard Codes	Xn:Harmful;
Risk Phrases	R20/21/22;R36/37/38
Safety Phrases	S26-S36/37/39
RIDADR	UN 2811
WGK Germany	3
RTECS	HP5386500
Packaging Group	III
Hazard Class	6.1

Synonyms

4,4'-Di-tert-butyldibenzo-18-crown-6

AR,AR'-DI-TERT-BUTYLDIBENZO-18-CROWN-6

MFCD00068541

4,45-Di-tert.-butylbenzo-18-crown-6,mixture of isomers

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