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| CAS No.: | 79418-78-3 |
|---|---|
| Name: | 3-FLUORO-4-HYDROXY-5-METHOXYBENZALDEHYDE |
| Article Data: | 9 |
| Molecular Structure: | |
|
|
|
| Formula: | C8H7FO3 |
| Molecular Weight: | 170.14 |
| Synonyms: | 3-Fluoro-5-methoxy-4-hydroxybenzaldehyde;5-Fluoro-4-hydroxy-3-methoxybenzaldehyde;5-Fluorovanillin; |
| Density: | 1.331 g/cm3 |
| Melting Point: | 114-118 °C(lit.) |
| Boiling Point: | 248.6 °C at 760 mmHg |
| Flash Point: | 104.1 °C |
| Appearance: | white to light yellow crystal powder |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 46.53000 |
| LogP: | 1.35240 |
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Chemistry
Molecular Structure of Benzaldehyde,3-fluoro-4-hydroxy-5-methoxy- (CAS No.79418-78-3):
Molecular Formula: C8H7FO3
Molecular Weight: 170.1378
IUPAC Name: 3-Fluoro-4-hydroxy-5-methoxybenzaldehyde
CAS No: 79418-78-3
H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 3
Polar Surface Area: 35.53 Å2
Index of Refraction: 1.564
Molar Refractivity: 41.55 cm3
Molar Volume: 127.7 cm3
Surface Tension: 45.1 dyne/cm
Density: 1.331 g/cm3
Flash Point: 104.1 °C
Enthalpy of Vaporization: 50.54 kJ/mol
Boiling Point: 248.6 °C at 760 mmHg
Vapour Pressure: 0.0153 mmHg at 25°C
Melting Point: 114-118 °C(lit.)
Product Categories: Aromatic Aldehydes Derivatives (substituted);Aldehydes;C8;Carbonyl Compounds
InChI: InChI=1/C8H7FO3/c1-12-7-3-5(4-10)2-6(9)8(7)11/h2-4,11H,1H3
InChIKey: OOGOFUKAJDPHDJ-UHFFFAOYAU
Std. InChI: InChI=1S/C8H7FO3/c1-12-7-3-5(4-10)2-6(9)8(7)11/h2-4,11H,1H3
Std. InChIKey: OOGOFUKAJDPHDJ-UHFFFAOYSA-N
Safety Profile
Safety Information of Benzaldehyde,3-fluoro-4-hydroxy-5-methoxy- (CAS No.79418-78-3):
Hazard Codes: 
Xi
Risk Statements: 36/37/38
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany: 3
Hazard Note: Irritant
Specification
Benzaldehyde,3-fluoro-4-hydroxy-5-methoxy- (CAS No.79418-78-3), it also can be called 3-Fluoro-4-hydroxy-5-methoxybenzaldehyde . It is white to light yellow crystal powder.