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2,2-Dimethyl-1,3-dioxolane-4-carboxylic acid

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Name

2,2-Dimethyl-1,3-dioxolane-4-carboxylic acid

EINECS N/A
CAS No. 62075-55-2 Density 1.203 g/cm3
PSA 55.76000 LogP 0.22250
Solubility N/A Melting Point N/A
Formula C6H10O4 Boiling Point 244.151 °C at 760 mmHg
Molecular Weight 146.1412 Flash Point 101.605 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 62075-55-2 (2,2-Dimethyl-1,3-dioxolane-4-carboxylic acid) Hazard Symbols N/A
Synonyms

1, 3-Dioxolane-4-carboxylic acid, 2, 2-dimethyl-;

Article Data 46

2,2-Dimethyl-1,3-dioxolane-4-carboxylic acid Specification

The 2, 2-Dimethyl-1, 3-dioxolane-4-carboxylic acid, with the CAS registry number of 62075-55-2, is also known as 1, 3-Dioxolane-4-carboxylic acid, 2, 2-dimethyl-. It belongs to the product category of Heterocycles Series. This chemical's molecular formula is C6H10O4 and molecular weight is 146.1412.

Physical properties about 2, 2-Dimethyl-1, 3-dioxolane-4-carboxylic acid are: (1)ACD/LogP: 0.47; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 55.76 Å2; (11)Index of Refraction: 1.447; (12)Molar Refractivity: 32.474 cm3; (13)Molar Volume: 121.466 cm3; (14)Polarizability: 12.874×10-24 cm3; (15)Surface Tension: 36.124 dyne/cm; (16)Density: 1.203 g/cm3; (17)Flash Point: 101.605 °C; (18)Enthalpy of Vaporization: 52.992 kJ/mol; (19)Boiling Point: 244.151 °C at 760 mmHg; (20)Vapour Pressure: 0.01 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CC1(OCC(O1)C(=O)O)C
(2) InChI: InChI=1/C6H10O4/c1-6(2)9-3-4(10-6)5(7)8/h4H,3H2,1-2H3,(H,7,8)
(3) InChIKey: OZPFVBLDYBXHAF-UHFFFAOYAG

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