2-Methoxy-2-methylpropanoic acid supplier

Name
2-Methoxy-2-methylpropanoic acid
EINECS
CAS No. 13836-62-9
Article Data2
CAS DataBase
Density 1.053 g/cm³
Solubility
Melting Point
Formula C₅H₁₀O₃
Boiling Point 205 °C at 760 mmHg
Molecular Weight 118.133
Flash Point 84.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Methoxyisobutyric acid;
PSA 46.53000
LogP 0.49600

2-Methoxy-2-methylpropanoic acid Specification

The 2-Methoxy-2-methylpropanoic acid, with the CAS registry number 13836-62-9, is also known as 2-Methoxyisobutyric acid. This chemical's molecular formula is C₅H₁₀O₃ and molecular weight is 118.13. What's more, both its IUPAC name and systematic name are the same which is called 2-Methoxy-2-methylpropanoic acid.

Physical properties about 2-Methoxy-2-methylpropanoic acid are: (1)ACD/LogP: -0.266; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.03; (4)ACD/LogD (pH 7.4): -3.67; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 1.00; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.422; (14)Molar Refractivity: 28.48 cm³; (15)Molar Volume: 112.1 cm³; (16)Polarizability: 11.29×10^-24cm³; (17)Surface Tension: 32.4 dyne/cm; (18)Density: 1.053 g/cm³; (19)Flash Point: 84.5 °C; (20)Enthalpy of Vaporization: 48.62 kJ/mol; (21)Boiling Point: 205 °C at 760 mmHg; (22)Vapour Pressure: 0.105 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)C(OC)(C)C
(2) InChI: InChI=1S/C5H10O3/c1-5(2,8-3)4(6)7/h1-3H3,(H,6,7)
(3) InChIKey: BKBZFJRHYSCZQA-UHFFFAOYSA-N

Product Name

2-Methoxy-2-methylpropanoic acid

2-Methoxy-2-methylpropanoic acid Specification

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