Products Categories
CAS No.: | 18368-95-1 |
---|---|
Name: | p-menthatriene,p-mentha-1,3,8-triene |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C10H14 |
Molecular Weight: | 134.221 |
Synonyms: | p-Mentha-1,3,8-triene(6CI,7CI,8CI);1,3,8-p-Menthatriene;p-Menta-1,3,8-triene;1-Methyl-4-prop-1-en-2-ylcyclohexa-1,3-diene;1-Methyl-4-(prop-1-en-2-yl)cyclohexa-1,3-diene; |
Density: | 0.868 g/cm3 |
Boiling Point: | 196.6 °C at 760 mmHg |
Flash Point: | 54.6 °C |
PSA: | 0.00000 |
LogP: | 3.22900 |
What can I do for you?
Get Best Price
The 1,3-Cyclohexadiene,1-methyl-4-(1-methylethenyl)-, with the CAS registry number 18368-95-1, is also known as p-Menta-1,3,8-triene. This chemical's molecular formula is C10H14 and molecular weight is 134.22. What's more, its systematic name is 1-Methyl-4-(prop-1-en-2-yl)cyclohexa-1,3-diene.
Physical properties of 1,3-Cyclohexadiene,1-methyl-4-(1-methylethenyl)- are: (1)ACD/LogP: 4.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.11; (4)ACD/LogD (pH 7.4): 4.11; (5)ACD/BCF (pH 5.5): 783.01; (6)ACD/BCF (pH 7.4): 783.01; (7)ACD/KOC (pH 5.5): 4101.68; (8)ACD/KOC (pH 7.4): 4101.68; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.493; (13)Molar Refractivity: 44.95 cm3; (14)Molar Volume: 154.5 cm3; (15)Polarizability: 17.82×10-24 cm3; (16)Surface Tension: 27.5 dyne/cm; (17)Density: 0.868 g/cm3; (18)Flash Point: 54.6 °C; (19)Enthalpy of Vaporization: 41.51 kJ/mol; (20)Boiling Point: 196.6 °C at 760 mmHg; (21)Vapour Pressure: 0.555 mmHg at 25°C.
Uses of 1,3-Cyclohexadiene,1-methyl-4-(1-methylethenyl)-: it can be used to produce 1-methyl-4-(1-methylethenyl)-2,3-dioxabicyclo[2.2.2]oct-5-ene. It will need reagents Ca-hypochlorite, NaOH, H2O2 and solvents methanol, H2O with the reaction time of 24 hours. The yield is about 31%.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC=C(CC1)C(=C)C
(2)InChI: InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4,6H,1,5,7H2,2-3H3
(3)InChIKey: XNMPFDIYAMOYRM-UHFFFAOYSA-N