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endo-Tetrahydrodicyclopentadiene

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Name

endo-Tetrahydrodicyclopentadiene

EINECS 220-586-3
CAS No. 2825-83-4 Density 0.977 g/cm3
PSA 0.00000 LogP 2.83260
Solubility N/A Melting Point 75 °C
Formula C10H16 Boiling Point 192.519 °C at 760 mmHg
Molecular Weight 136.237 Flash Point 40.556 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 2825-83-4 (ENDO-TETRAHYDRODICYCLOPENTADIENE) Hazard Symbols N/A
Synonyms

4,7-Methano-1H-indene,octahydro-, (3aa,4a,7a,7aa)-;4,7-Methanoindan, hexahydro-, endo- (8CI);endo-Tetrahydrobicyclopentadiene;endo-Tetrahydrodicyclopentadiene;endo-Tricyclo[5.2.1.02,6]decane;endo-Trimethylenenorbornane;

Article Data 86

endo-Tetrahydrodicyclopentadiene Specification

The systematic name of endo-Tetrahydrodicyclopentadiene is (3aR,4R,7S,7aS)-octahydro-1H-4,7-methanoindene. With the CAS registry number 2825-83-4, it is also named as 4,7-Methano-1H-indene, octahydro-, (3aR,4R,7S,7aS)-rel-. The product should be stored in closed, cool and dry place. Besides, it is an intermediate used in organic synthesis. And it can be used in the production of antioxidant 2246 and 2246-S, UV-326. In addition, its molecular formula is C10H16 and molecular weight is 136.23.

The other characteristics of endo-Tetrahydrodicyclopentadiene can be summarized as: (1)ACD/LogP: 4.36; (2)ACD/LogD (pH 5.5): 4; (3)ACD/LogD (pH 7.4): 4; (4)ACD/BCF (pH 5.5): 952; (5)ACD/BCF (pH 7.4): 952; (6)ACD/KOC (pH 5.5): 4718; (7)ACD/KOC (pH 7.4): 4718; (8)Index of Refraction: 1.517; (9)Molar Refractivity: 42.222 cm3; (10)Molar Volume: 139.448 cm3; (11)Polarizability: 16.738x10-24cm3; (12)Surface Tension: 34.456 dyne/cm; (13)Enthalpy of Vaporization: 41.117 kJ/mol; (14)Vapour Pressure: 0.678 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)Canonical SMILES: C1CC2C3CCC(C3)C2C1
(2)InChI: InChI=1S/C10H16/c1-2-9-7-4-5-8(6-7)10(9)3-1/h7-10H,1-6H2 
(3)InChIKey: LPSXSORODABQKT-UHFFFAOYSA-N

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