Benzoicacid, 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester supplier

Name
(3-CHLORO-4-ETHOXYCARBONYL)BENZENEBORONIC ACID
EINECS
CAS No. 474709-76-7
Article Data2
CAS DataBase
Density 1.16 g/cm³
Solubility
Melting Point
Formula C₁₅H₂₀BClO₄
Boiling Point 401.335 °C at 760 mmHg
Molecular Weight 310.5809
Flash Point 196.521 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Ethyl 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate;
PSA 44.76000
LogP 2.81590

Benzoicacid, 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester Specification

The Benzoicacid, 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester, with the CAS registry number 474709-76-7, is also known as Ethyl 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate. This chemical's molecular formula is C₁₅H₂₀BClO₄ and molecular weight is 310.5809. What's more, it should be stored in condition of cold and dry. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about Benzoicacid, 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester are: (1)#H bond acceptors: 4; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 44.76 Å²; (5)Index of Refraction: 1.509; (6)Molar Refractivity: 80.028 cm³; (7)Molar Volume: 267.852 cm³; (8)Polarizability: 31.725×10^-24cm³; (9)Surface Tension: 37.523 dyne/cm; (10)Density: 1.16 g/cm³; (11)Flash Point: 196.521 °C; (12)Enthalpy of Vaporization: 65.233 kJ/mol; (13)Boiling Point: 401.335 °C at 760 mmHg; (14)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CC1(C)OB(OC1(C)C)c2ccc(C(=O)OCC)c(Cl)c2
(2) InChI: InChI=1/C15H20BClO4/c1-6-19-13(18)11-8-7-10(9-12(11)17)16-20-14(2,3)15(4,5)21-16/h7-9H,6H2,1-5H3
(3) InChIKey: GYLSDPPQNVGXBD-UHFFFAOYAI

Product Name

(3-CHLORO-4-ETHOXYCARBONYL)BENZENEBORONIC ACID

Benzoicacid, 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester Specification

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