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CAS No.: | 51061-83-7 |
---|---|
Name: | 2,4-Dihydroxy-5-methoxybenzaldehyde |
Article Data: | 31 |
Molecular Structure: | |
Formula: | C8H8O4 |
Molecular Weight: | 168.149 |
Synonyms: | Benzaldehyde, 2,4-dihydroxy-5-methoxy-; |
Density: | 1.378 g/cm3 |
Melting Point: | 148-153°C |
Boiling Point: | 350.7 °C at 760 mmHg |
Flash Point: | 148.2 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36-43 |
Safety: | 26-36/37 |
PSA: | 66.76000 |
LogP: | 0.91890 |
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The 2,4-Dihydroxy-5-methoxybenzaldehyde, with the CAS registry number 51061-83-7, is also known as Benzaldehyde, 2,4-dihydroxy-5-methoxy-. This chemical's molecular formula is C8H8O4 and molecular weight is 168.1467. Its systematic name is called 2,4-dihydroxy-5-methoxybenzaldehyde.
Physical properties of 2,4-Dihydroxy-5-methoxybenzaldehyde: (1)ACD/LogP: 1.08; (2)ACD/LogD (pH 5.5): 1.08; (3)ACD/LogD (pH 7.4): 0.84; (4)ACD/BCF (pH 5.5): 3.88; (5)ACD/BCF (pH 7.4): 2.24; (6)ACD/KOC (pH 5.5): 91.59; (7)ACD/KOC (pH 7.4): 52.91; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.63; (12)Molar Refractivity: 43.44 cm3; (13)Molar Volume: 121.9 cm3; (14)Surface Tension: 59.7 dyne/cm; (15)Density: 1.378 g/cm3; (16)Flash Point: 148.2 °C; (17)Enthalpy of Vaporization: 61.89 kJ/mol; (18)Boiling Point: 350.7 °C at 760 mmHg; (19)Vapour Pressure: 2.13E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cc(OC)c(O)cc1O
(2)InChI: InChI=1/C8H8O4/c1-12-8-2-5(4-9)6(10)3-7(8)11/h2-4,10-11H,1H3
(3)InChIKey: ZFZAFNQYRZGWNK-UHFFFAOYAV