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Benzaldehyde,4-hydroxy-2,5-dimethyl- (85231-15-8)

Identification
Name:Benzaldehyde,4-hydroxy-2,5-dimethyl-
Synonyms:2,5-Dimethyl-4-hydroxybenzaldehyde;4-Formyl-2,5-dimethylphenol;4-Hydroxy-2,5-dimethylbenzaldehyde;
CAS:85231-15-8
Molecular Formula: C9H10O2
Molecular Weight: 150.17
Molecular Structure: (C9H10O2) 2,5-Dimethyl-4-hydroxybenzaldehyde;4-Formyl-2,5-dimethylphenol;4-Hydroxy-2,5-dimethylbenzaldehyde;
Properties
Density:1.137 g/cm3
Specification:

The CAS register number of 4-Hydroxy-2,5-dimethylbenzaldehyde is 85231-15-8. It also can be called as Benzaldehyde,4-hydroxy-2,5-dimethyl- and the IUPAC name about this chemical is 4-hydroxy-2,5-dimethylbenzaldehyde. The molecular formula about this chemical is C9H10O2 and molecular weight is 150.17. It belongs to the Pharmacetical.

Physical properties about 4-Hydroxy-2,5-dimethylbenzaldehyde are: (1)ACD/LogP: 2.39; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 34; (5)ACD/BCF (pH 7.4): 30; (6)ACD/KOC (pH 5.5): 431; (7)ACD/KOC (pH 7.4): 378; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 37.3Å2; (12)Index of Refraction: 1.589; (13)Molar Refractivity: 44.537 cm3; (14)Molar Volume: 132.08 cm3; (15)Polarizability: 17.656x10-24cm3; (16)Surface Tension: 45.287 dyne/cm; (17)Enthalpy of Vaporization: 53.153 kJ/mol; (18)Boiling Point: 272.669 °C at 760 mmHg; (19)Vapour Pressure: 0.004 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(C=O)c(C)cc1O
(2)InChI: InChI=1/C9H10O2/c1-6-4-9(11)7(2)3-8(6)5-10/h3-5,11H,1-2H3
(3)InChIKey: XLIMLVMYIYSMIQ-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C9H10O2/c1-6-4-9(11)7(2)3-8(6)5-10/h3-5,11H,1-2H3
(5)Std. InChIKey: XLIMLVMYIYSMIQ-UHFFFAOYSA-N

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