4-(Methoxymethoxy)phenylboronic acid supplier

Name
4-(METHOXYMETHYL)PHENYLBORONIC ACID
EINECS
CAS No. 162662-27-3
Article Data6
CAS DataBase
Density 1.195 g/cm³
Solubility
Melting Point
Formula C₈H₁₁BO₄
Boiling Point 346.27 °C at 760 mmHg
Molecular Weight 181.984
Flash Point 163.218 °C
Transport Information
Appearance
Safety 26-39
Risk Codes 22-41
Molecular Structure
Hazard Symbols Xi
Synonyms Boronicacid, [4-(methoxymethoxy)phenyl]- (9CI);4-Methoxymethoxyphenylboronic acid;
PSA 58.92000
LogP -0.65090

4-(Methoxymethoxy)phenylboronic acid Specification

This chemical is called Boronic acid, B-[4-(methoxymethoxy)phenyl]-, and its systematic name is [4-(methoxymethoxy)phenyl]boronic acid. With the molecular formula of C₈H₁₁BO₄, its molecular weight is 181.98. The CAS registry number of this chemical is 162662-27-3. Additionally, its product categories are Boronic Acids; Aryl; Organo Borons.

Other characteristics of the Boronic acid, B-[4-(methoxymethoxy)phenyl]- can be summarised as followings: (1)ACD/LogP: 0.91; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.91; (4)ACD/LogD (pH 7.4): 0.88; (5)ACD/BCF (pH 5.5): 2.87; (6)ACD/BCF (pH 7.4): 2.71; (7)ACD/KOC (pH 5.5): 74.09; (8)ACD/KOC (pH 7.4): 69.92; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 36.92 Å²; (13)Index of Refraction: 1.516; (14)Molar Refractivity: 46.02 cm³; (15)Molar Volume: 152.3 cm³; (16)Polarizability: 18.24×10^-24cm³; (17)Surface Tension: 43.2 dyne/cm; (18)Density: 1.19 g/cm³; (19)Flash Point: 163.2 °C; (20)Enthalpy of Vaporization: 62.31 kJ/mol; (21)Boiling Point: 346.3 °C at 760 mmHg; (22)Vapour Pressure: 2.21E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O(COc1ccc(cc1)B(O)O)C
2.InChI: InChI=1/C8H11BO4/c1-12-6-13-8-4-2-7(3-5-8)9(10)11/h2-5,10-11H,6H2,1H
3.InChIKey: MERYVSUVKVVJMP-UHFFFAOYAC

Product Name

4-(METHOXYMETHYL)PHENYLBORONIC ACID

4-(Methoxymethoxy)phenylboronic acid Specification

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