Basic Information | Post buying leads | Suppliers |
Name |
Isononyl acetate |
EINECS | 254-898-6 |
CAS No. | 40379-24-6 | Density | 0.87g/cm3 |
PSA | 26.30000 | LogP | 3.01190 |
Solubility | 12.56mg/L at 25℃ | Melting Point |
-26°C (estimate) |
Formula | C11H22O2 | Boiling Point | 214.2°Cat760mmHg |
Molecular Weight | 186.294 | Flash Point | 82.9°C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
i-Nonyl acetate;iso nonyl acetate; |
Molecule structure of Isononyl acetate (CAS NO.40379-24-6):
IUPAC Name: 7-Methyloctyl acetate
Molecular Weight: 186.29118 [g/mol]
Molecular Formula: C11H22O2
Index of Refraction: 1.425
Molar Refractivity: 54.74 cm3
Molar Volume: 213.9 cm3
Surface Tension: 27.9 dyne/cm
Density: 0.87 g/cm3
Flash Point: 82.9 °C
Enthalpy of Vaporization: 45.05 kJ/mol
Boiling Point: 214.2 °C at 760 mmHg
Vapour Pressure: 0.158 mmHg at 25 °C
XLogP3: 3.7
H-Bond Acceptor: 2
Rotatable Bond Count: 8
Exact Mass: 186.16198
MonoIsotopic Mass: 186.16198
Topological Polar Surface Area: 26.3
Heavy Atom Count: 13
Canonical SMILES: CC(C)CCCCCCOC(=O)C
InChI: InChI=1S/C11H22O2/c1-10(2)8-6-4-5-7-9-13-11(3)12/h10H,4-9H2,1-3H3
InChIKey: LJSJTXAZFHYHMM-UHFFFAOYSA-N
EINECS of Isononyl acetate (CAS NO.40379-24-6): 254-898-6
Isononyl acetate (CAS NO.40379-24-6) is also named as Acetic acid, isononyl ester .