Products Categories
CAS No.: | 65443-14-3 |
---|---|
Name: | 2,2,5-TRIMETHYL-5-PENTYLCYCLOPENTANONE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C13H24O |
Molecular Weight: | 196.333 |
Synonyms: | 2,2,5-Trimethyl-5-pentylcyclopentanone;Veloutone; |
EINECS: | 265-779-3 |
Density: | 0.856g/cm3 |
Boiling Point: | 247.2 °C at 760 mmHg |
Flash Point: | 96 °C |
Solubility: | 18.9mg/L at 20℃ |
PSA: | 17.07000 |
LogP: | 3.96210 |
What can I do for you?
Get Best Price
The 2,2,5-Trimethyl-5-pentylcyclopentanone, with cas registry number 65443-14-3, has the systematic name of 2,2,5-trimethyl-5-pentylcyclopentanone. And its IUPAC name is the same one. Its other registry number is 193818-98-3. What's more, its EINECS is 265-779-3.
Physical properties about this chemical are: (1)ACD/LogP: 4.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.39; (4)ACD/LogD (pH 7.4): 4.39; (5)ACD/BCF (pH 5.5): 1275.64; (6)ACD/BCF (pH 7.4): 1275.64; (7)ACD/KOC (pH 5.5): 5816.72; (8)ACD/KOC (pH 7.4): 5816.72; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.439; (14)Molar Refractivity: 60.34 cm3; (15)Molar Volume: 229.1 cm3; (16)Polarizability: 23.92×10-24cm3; (17)Surface Tension: 26.2 dyne/cm; (18)Enthalpy of Vaporization: 48.43 kJ/mol; (19)Vapour Pressure: 0.0261 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1C(C)(CCCCC)CCC1(C)C
(2)InChI: InChI=1/C13H24O/c1-5-6-7-8-13(4)10-9-12(2,3)11(13)14/h5-10H2,1-4H3
(3)InChIKey: PUKWIVZFEZFVAT-UHFFFAOYAP
(4)Std. InChI: InChI=1S/C13H24O/c1-5-6-7-8-13(4)10-9-12(2,3)11(13)14/h5-10H2,1-4H3
(5)Std. InChIKey: PUKWIVZFEZFVAT-UHFFFAOYSA-N