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4,7-Methano-1H-indene,octahydro-, (3aR,4R,7S,7aS)-rel- (2825-83-4)

Identification
Name:4,7-Methano-1H-indene,octahydro-, (3aR,4R,7S,7aS)-rel-
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;
CAS:2825-83-4
EINECS: 220-586-3
Molecular Formula: C10H16
Molecular Weight: 136.23
InChI: InChI=1/C10H16/c1-2-9-7-4-5-8(6-7)10(9)3-1/h7-10H,1-6H2
Molecular Structure: (C10H16) 4,7-Methano-1H-indene,octahydro-, (3aa,4a,7a,7aa)-;4,7-Methanoindan, hexahydro-, endo- (8CI);endo-Te...
Properties
Melting Point: 75 °C
Flash Point: 40.6°C
Boiling Point: 192.5°Cat760mmHg
Density:0.976g/cm3
Refractive index:1.517
Specification:

The endo-Tetrahydrodicyclopentadiene with its cas register number is 2825-83-4. It also can be called as ((3aalpha,4alpha,7alpha,7aalpha)-Octahydro-4,7-methano-1H-
indene and the Systematic name about this chemical is (3aR,4R,7S,7aS)-octahydro-1H-4,7-methanoindene.

Physical properties about endo-Tetrahydrodicyclopentadiene are: (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.

You can still convert the following datas into molecular 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

Flash Point: 40.6°C
Safety Data
 

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