2-Cyclohexene-1-carboxaldehyde,3,5,5-trimethyl- supplier

Name
3,5,5-trimethylcyclohex-2-ene-1-carbaldehyde
EINECS 283-186-8
CAS No. 84559-99-9
Article Data3
CAS DataBase
Density 0.935 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₆O
Boiling Point 197.3 °C at 760 mmHg
Molecular Weight 152.236
Flash Point 64.5 °
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3, 5, 5-Trimethyl-2-cyclohexene-1-carbaldehyde;
PSA 17.07000
LogP 2.56780

2-Cyclohexene-1-carboxaldehyde,3,5,5-trimethyl- Specification

The 2-Cyclohexene-1-carboxaldehyde, 3, 5, 5-trimethyl-, with the CAS registry number 84559-99-9, is also known as 3, 5, 5-Trimethyl-2-cyclohexene-1-carbaldehyde. Its EINECS registry number is 283-186-8. This chemical's molecular formula is C₁₀H₁₆O and molecular weight is 152.23344. What's more, its IUPAC name is 3, 5, 5-Trimethylcyclohex-2-ene-1-carbaldehyde.

hysical properties about 2-Cyclohexene-1-carboxaldehyde, 3, 5, 5-trimethyl- are: (1)ACD/LogP: 3.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.19; (4)ACD/LogD (pH 7.4): 3.19; (5)ACD/BCF (pH 5.5): 156.3; (6)ACD/BCF (pH 7.4): 156.3; (7)ACD/KOC (pH 5.5): 1294.32; (8)ACD/KOC (pH 7.4): 1294.32; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å²; (13)Index of Refraction: 1.5; (14)Molar Refractivity: 47.9 cm³; (15)Molar Volume: 162.7 cm³; (16)Polarizability: 18.99×10^-24 cm³; (17)Surface Tension: 32.3 dyne/cm; (18)Density: 0.935 g/cm³; (19)Flash Point: 64.5 °C; (20)Enthalpy of Vaporization: 43.35 kJ/mol; (21)Boiling Point: 197.3 °C at 760 mmHg; (22)Vapour Pressure: 0.382 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=CC1\C=C(/CC(C)(C)C1)C
(2) InChI: InChI=1/C10H16O/c1-8-4-9(7-11)6-10(2,3)5-8/h4,7,9H,5-6H2,1-3H3
(3) InChIKey: YONAHFYUNJWCOX-UHFFFAOYAL

Product Name

3,5,5-trimethylcyclohex-2-ene-1-carbaldehyde

2-Cyclohexene-1-carboxaldehyde,3,5,5-trimethyl- Specification

Related Products

Hot Products