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| CAS No.: | 52289-54-0 |
|---|---|
| Name: | 4-METHOXY-2-METHYLBENZALDEHYDE |
| Article Data: | 26 |
| Molecular Structure: | |
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| Formula: | C9H10O2 |
| Molecular Weight: | 150.177 |
| Synonyms: | 2-Methyl-4-methoxybenzaldehyde; |
| Density: | 1.062 g/cm3 |
| Boiling Point: | 264.1 °C at 760 mmHg |
| Flash Point: | 118.9 °C |
| PSA: | 26.30000 |
| LogP: | 1.81610 |
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Specification
This chemical has the IUPAC name 4-Methoxy-2-methyl-benzaldehyde. With CAS registry number 52289-54-0, it's also named as 2-Methyl-p-anisaldehyde. It belongs to the product category Aromatic Aldehydes & Derivatives (substituted). It has the molecular formula C9H10O2. Besides, this chemical should be sealed in the cool and dry place.
Physical properties of 4-Methoxy-2-methyl-benzaldehyde: (1)ACD/LogP: 2.16; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.542; (8)Molar Refractivity: 44.5 cm3; (9)Molar Volume: 141.3 cm3; (10)Polarizability: 17.64×10-24cm3; (11)Surface Tension: 36.1 dyne/cm; (12)Density: 1.062 g/cm3; (13)Flash Point: 118.9 °C; (14)Enthalpy of Vaporization: 50.2 kJ/mol; (15)Boiling Point: 264.1 °C at 760 mmHg; (16)Vapour Pressure: 0.00987 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1c(cc(OC)cc1)C
(2)InChI: InChI=1/C9H10O2/c1-7-5-9(11-2)4-3-8(7)6-10/h3-6H,1-2H3
(3)InChIKey: WICYVKGMEJSDAO-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C9H10O2/c1-7-5-9(11-2)4-3-8(7)6-10/h3-6H,1-2H3
(5)Std. InChIKey: WICYVKGMEJSDAO-UHFFFAOYSA-N