1-Butanone,1-(1,3-benzodioxol-5-yl)- supplier

Name
3,4-(METHYLENEDIOXY)BUTYROPHENONE
EINECS
CAS No. 63740-97-6
Article Data11
CAS DataBase
Density 1.163 g/cm³
Solubility
Melting Point 47-49°C
Formula C₁₁H₁₂O₃
Boiling Point 319.3 °C at 760 mmHg
Molecular Weight 192.214
Flash Point 137.9 °C
Transport Information
Appearance
Safety 24/25
Risk Codes 22
Molecular Structure
Hazard Symbols Xn
Synonyms 5-Butyryl-1,3-benzodioxole;
PSA 35.53000
LogP 2.39810

1-Butanone,1-(1,3-benzodioxol-5-yl)- Specification

The 1-Butanone,1-(1,3-benzodioxol-5-yl)-, with the CAS registry number 63740-97-6, is also known as 5-Butyryl-1,3-benzodioxole. This chemical's molecular formula is C₁₁H₁₂O₃ and molecular weight is 192.21. Its systematic name is called 1-(1,3-benzodioxol-5-yl)butan-1-one. When you are using this chemical, please be cautious about it, you should avoid contacting it with skin and eyes.

Physical properties of 1-Butanone,1-(1,3-benzodioxol-5-yl)-: (1)#H bond acceptors: 3; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 3; (4)Index of Refraction: 1.538; (5)Molar Refractivity: 51.7 cm³; (6)Molar Volume: 165.1 cm³; (7)Surface Tension: 44.8 dyne/cm; (8)Density: 1.163 g/cm³; (9)Flash Point: 137.9 °C; (10)Enthalpy of Vaporization: 56.08 kJ/mol; (11)Boiling Point: 319.3 °C at 760 mmHg; (12)Vapour Pressure: 0.000342 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccc2OCOc2c1)CCC
(2)InChI: InChI=1/C11H12O3/c1-2-3-9(12)8-4-5-10-11(6-8)14-7-13-10/h4-6H,2-3,7H2,1H3
(3)InChIKey: VHOZZIUFGVJOEL-UHFFFAOYAR

Product Name

3,4-(METHYLENEDIOXY)BUTYROPHENONE

1-Butanone,1-(1,3-benzodioxol-5-yl)- Specification

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