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| CAS No.: | 1087-02-1 |
|---|---|
| Name: | 1,4-DICYCLOHEXYLBENZENE |
| Molecular Structure: | |
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| Formula: | C18H26 |
| Molecular Weight: | 242.404 |
| Synonyms: | 1,4-Dicyclohexylbenzene;NSC 6353;p-Dicyclohexylbenzene; |
| EINECS: | 214-121-3 |
| Density: | 0.962 g/cm3 |
| Melting Point: | 103-105 °C(lit.) |
| Boiling Point: | 365.8 °C at 760 mmHg |
| Flash Point: | 170.6 °C |
| Appearance: | slightly beige fine crystalline powder |
| Risk Codes: | 36/37/38 |
| Safety: | 37/39-24/25 |
| PSA: | 0.00000 |
| LogP: | 5.78200 |
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Specification
The Benzene,1,4-dicyclohexyl-, with the CAS registry number 1087-02-1, is also known as p-Dicyclohexylbenzene. Its EINECS number is 214-121-3. This chemical's molecular formula is C18H26 and molecular weight is 242.40. What's more, its IUPAC name is 1,4-Dicyclohexylbenzene. It is stable at room temperature and pressure, and it should be sealed and stored in a cool and dry place and be protected from strong oxidizes.
Physical properties of Benzene,1,4-dicyclohexyl- are: (1)ACD/LogP: 7.26; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7.26; (4)ACD/LogD (pH 7.4): 7.26; (5)ACD/BCF (pH 5.5): 193100.45; (6)ACD/BCF (pH 7.4): 193100.45; (7)ACD/KOC (pH 5.5): 211416.81; (8)ACD/KOC (pH 7.4): 211416.81; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.531; (14)Molar Refractivity: 77.97 cm3; (15)Molar Volume: 251.8 cm3; (16)Polarizability: 30.91×10-24 cm3; (17)Surface Tension: 36.7 dyne/cm; (18)Density: 0.962 g/cm3; (19)Flash Point: 170.6 °C; (20)Enthalpy of Vaporization: 58.8 kJ/mol; (21)Boiling Point: 365.8 °C at 760 mmHg; (22)Vapour Pressure: 3.23E-05 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When using it, you need wear suitable protective clothing and eye/face protection and avoid contacting with skin and eyes .
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCC(CC1)C2=CC=C(C=C2)C3CCCCC3
(2)InChI: InChI=1S/C18H26/c1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16/h11-16H,1-10H2
(3)InChIKey: QQFSIGWYINAJOB-UHFFFAOYSA-N