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CAS No.: | 7603-37-4 |
---|---|
Name: | BICYCLO[4.3.0]NONA-3,6(1)-DIENE |
Article Data: | 13 |
Molecular Structure: | |
Formula: | C9H12 |
Molecular Weight: | 120.194 |
Synonyms: | Indan,4,7-dihydro- (6CI,7CI,8CI);2,3,4,7-Tetrahydro-1H-indene;2,3,4,7-Tetrahydroindene;4,7-Dihydroindan;Bicyclo[4.3.0]nona-1(6),3-diene; |
EINECS: | 231-514-5 |
Density: | 0.95 g/cm3 |
Boiling Point: | 178 °C at 760 mmHg |
Flash Point: | 10 °C |
Appearance: | COLORLESS LIQUID |
Hazard Symbols: | F |
Risk Codes: | 11 |
Safety: | 16-29-33 |
Transport Information: | UN 1993 |
PSA: | 0.00000 |
LogP: | 2.81690 |
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The 1H-Indene,2,3,4,7-tetrahydro-, with CAS registry number 7603-37-4, belongs to the following product categories: (1)Alkenes; (2)Cyclic; (3)Organic Building Blocks. It has the systematic name of 2,3,4,7-tetrahydro-1H-indene. And the chemical formula of this chemical is C9H12. What's more, its EINECS is 231-514-5.
Physical properties of 1H-Indene,2,3,4,7-tetrahydro-: (1)ACD/LogP: 3.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.35; (4)ACD/LogD (pH 7.4): 3.35; (5)ACD/BCF (pH 5.5): 208.52; (6)ACD/BCF (pH 7.4): 208.52; (7)ACD/KOC (pH 5.5): 1590.94; (8)ACD/KOC (pH 7.4): 1590.94; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.53; (14)Molar Refractivity: 38.99 cm3; (15)Molar Volume: 126 cm3; (16)Polarizability: 15.45×10-24cm3; (17)Surface Tension: 31.6 dyne/cm; (18)Density: 0.95 g/cm3; (19)Flash Point: 10 °C; (20)Enthalpy of Vaporization: 39.73 kJ/mol; (21)Boiling Point: 178 °C at 760 mmHg; (22)Vapour Pressure: 1.36 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The 1H-Indene,2,3,4,7-tetrahydro- is highly flammable, so keep it away from sources of ignition. Do not empty it into drains. And you should take precautionary measures against static discharges.
You can still convert the following datas into molecular structure:
(1)SMILES: C\1=C\C\C2=C(/C/1)CCC2
(2)InChI: InChI=1/C9H12/c1-2-5-9-7-3-6-8(9)4-1/h1-2H,3-7H2
(3)InChIKey: PJEOOBRBALZZSL-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C9H12/c1-2-5-9-7-3-6-8(9)4-1/h1-2H,3-7H2
(5)Std. InChIKey: PJEOOBRBALZZSL-UHFFFAOYSA-N