Propanal,3-methoxy-2,2-dimethyl- supplier

Name
3-methoxy-2,2-dimethylpropionaldehyde
EINECS 247-549-4
CAS No. 26254-86-4
Article Data7
CAS DataBase
Density 0.884 g/cm³
Solubility
Melting Point
Formula C₆H₁₂O₂
Boiling Point 144.6 °C at 760 mmHg
Molecular Weight 116.16
Flash Point 34.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-methoxy-2,2-dimethylpropionaldehyde;3-Methoxy-2,2-dimethylpropanal
PSA 26.30000
LogP 0.85790

Propanal,3-methoxy-2,2-dimethyl- Specification

The Propanal,3-methoxy-2,2-dimethyl- has CAS registry number 26254-86-4. Its EINECS number is 247-549-4. This chemical's molecular formula is C₆H₁₂O₂ and molecular weight is 116.16. What's more, its IUPAC name is 3-methoxy-2,2-dimethylpropanal.

Physical properties of Propanal,3-methoxy-2,2-dimethyl- are: (1)ACD/LogP: 0.55; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.55; (4)ACD/LogD (pH 7.4): 0.55; (5)ACD/BCF (pH 5.5): 1.54; (6)ACD/BCF (pH 7.4): 1.54; (7)ACD/KOC (pH 5.5): 47.48; (8)ACD/KOC (pH 7.4): 47.48; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.398; (14)Molar Refractivity: 31.74 cm³; (15)Molar Volume: 131.3 cm³; (16)Polarizability: 12.58×10^-24cm³; (17)Surface Tension: 25.3 dyne/cm; (18)Density: 0.884 g/cm³; (19)Flash Point: 34.2 °C; (20)Enthalpy of Vaporization: 38.17 kJ/mol; (21)Boiling Point: 144.6 °C at 760 mmHg; (22)Vapour Pressure: 5.05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=CC(C)(C)COC
(2)Std. InChI: InChI=1S/C6H12O2/c1-6(2,4-7)5-8-3/h4H,5H2,1-3H3
(3)Std. InChIKey: MSUXOWPAVUXNMZ-UHFFFAOYSA-N

Product Name

3-methoxy-2,2-dimethylpropionaldehyde

Propanal,3-methoxy-2,2-dimethyl- Specification

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