2-Hydroxy-5-methylisophthalaldehyde supplier

Name
2-HYDROXY-5-METHYLISOPHTHALALDEHYDE
EINECS 230-768-4
CAS No. 7310-95-4
Article Data55
CAS DataBase
Density 1.287 g/cm³
Solubility
Melting Point 128-130 °C(lit.)
Formula C₉H₈O₃
Boiling Point 237.4 °C at 760 mmHg
Molecular Weight 164.161
Flash Point 111.6 °C
Transport Information
Appearance light yellow to beige cryst. powder or needles
Safety 26-36
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms Isophthalaldehyde,2-hydroxy-5-methyl- (6CI,7CI,8CI);2,6-Diformyl-4-methylphenol;2,6-Diformyl-p-cresol;2-Hydroxy-5-methyl-1,3-benzenedicarboxaldehyde;2-Hydroxy-5-methyl-1,3-benzenedicarboxyaldehyde;2-Hydroxy-5-methylbenzene-1,3-dicarbaldehyde;2-Hydroxy-5-methylisophthalaldehyde;2-Hydroxy-5-methylisophthaldehyde;3-Formyl-5-methylsalicylaldehyde;4-Methyl-2,6-diformylphenol;5-Methyl-2-hydroxyisophthalaldehyde;NSC 243727;
PSA 54.37000
LogP 1.32560

2-Hydroxy-5-methylisophthalaldehyde Specification

This chemical is called 1,3-Benzenedicarboxaldehyde, 2-hydroxy-5-methyl-, and its IUPAC name is 2-hydroxy-5-methylbenzene-1,3-dicarbaldehyde. With the CAS registry number of 7310-95-4, its product categories are Aromatic Aldehydes & Derivatives(substituted); Aldehydes; C9; Carbonyl Compounds. Additionally, this chemical is light yellow to beige cryst. powder or needles.

Other characteristics of the 1,3-Benzenedicarboxaldehyde, 2-hydroxy-5-methyl- can be summarised as followings: (1)ACD/LogP: 2.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.45; (4)ACD/LogD (pH 7.4): 1.69; (5)ACD/BCF (pH 5.5): 41.94; (6)ACD/BCF (pH 7.4): 7.37; (7)ACD/KOC (pH 5.5): 496; (8)ACD/KOC (pH 7.4): 87.12; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 43.37 Å²; (13)Index of Refraction: 1.649; (14)Molar Refractivity: 46.46 cm³; (15)Molar Volume: 127.4 cm³; (16)Polarizability: 18.42×10^-24cm³; (17)Surface Tension: 56.8 dyne/cm; (18)Density: 1.287 g/cm³; (19)Flash Point: 111.6 °C; (20)Enthalpy of Vaporization: 49.34 kJ/mol; (21)Boiling Point: 237.4 °C at 760 mmHg; (22)Vapour Pressure: 0.0293 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O=Cc1cc(cc(C=O)c1O)C
2.InChI: InChI=1/C9H8O3/c1-6-2-7(4-10)9(12)8(3-6)5-11/h2-5,12H,1H3
3.InChIKey: ZBOUXALQDLLARY-UHFFFAOYAT

Product Name

2-HYDROXY-5-METHYLISOPHTHALALDEHYDE

2-Hydroxy-5-methylisophthalaldehyde Specification

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