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CAS No.: | 74367-33-2 |
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Name: | METHYLPROPANOICACID,C8HYDROXYESTER |
Molecular Structure: | |
Formula: | C12H24 O3 |
Molecular Weight: | 216.32 |
Synonyms: | METHYLPROPANOICACID,C8HYDROXYESTER;PROPANOICACID,2-METHYL-,2,2 |
Density: | 0.945g/cm3 |
Boiling Point: | 249°C at 760 mmHg |
Flash Point: | 85.1°C |
PSA: | 46.53000 |
LogP: | 2.22870 |
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Product Name: (1-Hydroxy-2,4,4-trimethylpentan-3-yl) 2-methylpropanoate (CAS NO.74367-33-2)
Molecular Formula: C12H24O3
Molecular Weight: 216.32g/mol
Mol File: 74367-33-2.mol
Index of Refraction: 1.444
Molar Refractivity: 60.79 cm3
Molar Volume: 228.7 cm3
Surface Tension: 30.6 dyne/cm
Density: 0.945 g/cm3
Flash Point: 85.1 °C
Enthalpy of Vaporization: 56.49 kJ/mol
Boiling Point: 249 °C at 760 mmHg
Vapour Pressure: 0.00378 mmHg at 25°C
XLogP3-AA: 3.1
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of (1-Hydroxy-2,4,4-trimethylpentan-3-yl) 2-methylpropanoate (CAS NO.74367-33-2):
IUPAC Name: (1-hydroxy-2,4,4-trimethylpentan-3-yl) 2-methylpropanoate
Canonical SMILES: CC(C)C(=O)OC(C(C)CO)C(C)(C)C
InChI: InChI=1S/C12H24O3/c1-8(2)11(14)15-10(9(3)7-13)12(4,5)6/h8-10,13H,7H2,1-6H3
InChIKey: YXISVHDWGVMPGJ-UHFFFAOYSA-N
(1-Hydroxy-2,4,4-trimethylpentan-3-yl) 2-methylpropanoate , its CAS NO. is 74367-33-2, the synonyms are Propanoic acid, 2-methyl-, 2,2-dimethyl-1-(2-hydroxy-1-methylethyl)propyl ester ; 2,2-Dimethyl-1-(2-hydroxy-1-isopropyl)propyl ester of isobutanoic acid .