Benzene, 1,4-dibutyl- supplier

Name
1,4-DI-N-BUTYLBENZENE
EINECS
CAS No. 1571-86-4
Article Data12
CAS DataBase
Density 0.856 g/cm³
Solubility
Melting Point -31 - -30°C
Formula C₁₄H₂₂
Boiling Point 263.5 °C at 760 mmHg
Molecular Weight 190.329
Flash Point 113 °C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,4-Di-n-butylbenzene;1,4-Dibutylbenzene;Benzene,p-dibutyl- (6CI,7CI,8CI);p-Dibutylbenzene;
PSA 0.00000
LogP 4.37180

Benzene, 1,4-dibutyl- Specification

The Benzene, 1,4-dibutyl-, with the CAS registry number 1571-86-4, is also known as 1,4-Di-tert-butylbenzene. This chemical's molecular formula is C₁₄H₂₂ and molecular weight is 190.32448. Its IUPAC name is called 1,4-dibutylbenzene. When you are using this chemical, please be cautious about it. You must avoid contacting it with skin and eyes.

Physical properties of Benzene, 1,4-dibutyl-: (1)ACD/LogP: 6.33; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.33; (4)ACD/LogD (pH 7.4): 6.33; (5)ACD/BCF (pH 5.5): 37858.98; (6)ACD/BCF (pH 7.4): 37858.98; (7)ACD/KOC (pH 5.5): 65862.3; (8)ACD/KOC (pH 7.4): 65862.3; (9)#Freely Rotating Bonds: 6; (10)Index of Refraction: 1.489; (11)Molar Refractivity: 63.88 cm³; (12)Molar Volume: 221 cm³; (13)Surface Tension: 30.5 dyne/cm; (14)Density: 0.86 g/cm³; (15)Flash Point: 113 °C; (16)Enthalpy of Vaporization: 48.12 kJ/mol; (17)Boiling Point: 263.5 °C at 760 mmHg; (18)Vapour Pressure: 0.0167 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCC1=CC=C(C=C1)CCCC
(2)InChI: InChI=1S/C14H22/c1-3-5-7-13-9-11-14(12-10-13)8-6-4-2/h9-12H,3-8H2,1-2H3
(3)InChIKey: VGQOZYOOFXEGDA-UHFFFAOYSA-N

Product Name

1,4-DI-N-BUTYLBENZENE

Benzene, 1,4-dibutyl- Specification

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