4-tert-Butyl-2-hydroxybenzaldehyde supplier

Name
4-tert-Butylsalicylaldehyde
EINECS 613-912-4
CAS No. 66232-34-6
Article Data9
CAS DataBase
Density 1.072 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₄O₂
Boiling Point 262.916 °C at 760 mmHg
Molecular Weight 178.231
Flash Point 109.169 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 2-Hydroxy-4-tert-butylbenzaldehyde;4-tert-Butyl-2-hydroxybenzaldehyde;4-tert-Butylsalicylaldehyde;
PSA 37.30000
LogP 2.50220

4-tert-Butyl-2-hydroxybenzaldehyde Specification

The 4-tert-Butyl-2-hydroxybenzaldehyde with cas registry number of 66232-34-6 is a kind of Benzaldehyde compounds. It is also known as 4-tert-Butylsalicylaldehyde. Both its systematic name and IUPAC name are the same which is called 4-tert-butyl-2-hydroxybenzaldehyde.

The physical properties about this chemical are: (1)ACD/LogP: 3.66; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 188; (6)ACD/BCF (pH 7.4): 167; (7)ACD/KOC (pH 5.5): 1476; (8)ACD/KOC (pH 7.4): 1312; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.554; (13)Molar Refractivity: 53.275 cm³; (14)Molar Volume: 166.217 cm³; (15)Surface Tension: 39.003 dyne/cm; (16)Density: 1.072 g/cm³; (17)Flash Point: 109.169 °C; (18)Enthalpy of Vaporization: 52.092 kJ/mol; (19)Boiling Point: 262.916 °C at 760 mmHg; (20)Vapour Pressure: 0.007 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1ccc(cc1O)C(C)(C)C;
(2)InChI: InChI=1/C11H14O2/c1-11(2,3)9-5-4-8(7-12)10(13)6-9/h4-7,13H,1-3H3;
(3)InChIKey: UYRSLWPKZKASRB-UHFFFAOYAZ

Product Name

4-tert-Butylsalicylaldehyde

4-tert-Butyl-2-hydroxybenzaldehyde Specification

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