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CAS No.: | 2438-20-2 |
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Name: | 2-Methylbutyl propionate |
Molecular Structure: | |
Formula: | C8H16O2 |
Molecular Weight: | 144.21 |
Synonyms: | 1-Butanol,2-methyl-, propanoate (9CI);1-Butanol, 2-methyl-, propionate (7CI,8CI);2-Methylbutyl propanoate;2-Methylbutyl propionate;Propionic acid2-methylbutyl ester; |
EINECS: | 219-449-0 |
Density: | 0.876 g/cm3 |
Melting Point: | -70.1°C (estimate) |
Boiling Point: | 156.3 °C at 760 mmHg |
Flash Point: | 46.7 °C |
Appearance: | Colorless liquid with sweet fruity fresh rum like odor |
PSA: | 26.30000 |
LogP: | 1.98570 |
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Molecular Structure of 1-Butanol, 2-methyl-,1-propanoate (CAS NO.2438-20-2):
IUPAC Name: 2-methylbutyl propanoate
Empirical Formula: C8H16O2
Molecular Weight: 144.2114
H bond acceptors: 2
H bond donors: 0
Freely Rotating Bonds: 5
Polar Surface Area: 26.3 Å2
Index of Refraction: 1.411
Molar Refractivity: 40.84 cm3
Molar Volume: 164.4 cm3
Surface Tension: 26.3 dyne/cm
Density: 0.876 g/cm3
Flash Point: 46.7 °C
Enthalpy of Vaporization: 39.3 kJ/mol
Boiling Point: 156.3 °C at 760 mmHg
Vapour Pressure: 2.91 mmHg at 25°C
CAS Registry Number: 2438-20-2
EINECS: 219-449-0
InChI
InChI=1/C8H16O2/c1-4-7(3)6-10-8(9)5-2/h7H,4-6H2,1-3H3
Smiles
O=C(OC[C@@H](CC)C)CC
Methyl-2-butyl-propionate ; methyl 2-methylhexanoate ; 1-butanol, 2-methyl-, propanoate ; 1-butanol, 2-methyl-, propionate ; 2-methylbutyl propionate ; 2-methyl-1-butanol propionate ; propionic acid (2-methylbutyl) ester .