Benzaldehyde,4-ethoxy-3-fluoro- supplier

Name
4-ETHOXY-3-FLUOROBENZALDEHYDE
EINECS
CAS No. 452-00-6
Article Data4
CAS DataBase
Density 1.153 g/cm³
Solubility
Melting Point
Formula C₉H₉FO₂
Boiling Point 262.403 °C at 760 mmHg
Molecular Weight 168.168
Flash Point 109.161 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Ethoxy-3-fluorobenzaldehyde;
PSA 26.30000
LogP 2.03690

Benzaldehyde,4-ethoxy-3-fluoro- Specification

The Benzaldehyde, 4-ethoxy-3-fluoro- has CAS registry number 452-00-6. This chemical's molecular formula is C₉H₉FO₂ and molecular weight is 168.16. What's more, its systematic name is called 4-Ethoxy-3-fluorobenzaldehyde.

Physical properties about Benzaldehyde, 4-ethoxy-3-fluoro- are: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 42; (6)ACD/BCF (pH 7.4): 42; (7)ACD/KOC (pH 5.5): 502; (8)ACD/KOC (pH 7.4): 502; (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: 1.52; (14)Molar Refractivity: 44.311 cm³; (15)Molar Volume: 145.818 cm³; (16)Surface Tension: 35.491 dyne/cm; (17)Density: 1.153 g/cm³; (18)Flash Point: 109.161 °C; (19)Enthalpy of Vaporization: 50.018 kJ/mol; (20)Boiling Point: 262.403 °C at 760 mmHg; (21)Vapour Pressure: 0.011 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CCOc1ccc(cc1F)C=O
(2) InChI: InChI=1/C9H9FO2/c1-2-12-9-4-3-7(6-11)5-8(9)10/h3-6H,2H2,1H3
(3) InChIKey: QSYSVOBKEQYYJN-UHFFFAOYAB

Product Name

4-ETHOXY-3-FLUOROBENZALDEHYDE

Benzaldehyde,4-ethoxy-3-fluoro- Specification

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