Diisopropyl (Bromomethyl)boronate supplier

Name
DIISOPROPYL(BROMOMETHYL)BORONATE
EINECS
CAS No. 137297-49-5
Article Data6
CAS DataBase
Density 1.156 g/cm³
Solubility
Melting Point
Formula C₇H₁₆BBrO₂
Boiling Point 138.7 °C at 760 mmHg
Molecular Weight 222.918
Flash Point 37.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Boronicacid, (bromomethyl)-, bis(1-methylethyl) ester (9CI);Diisopropyl(bromomethyl)boronate;
PSA 18.46000
LogP 2.67700

Diisopropyl (Bromomethyl)boronate Specification

This chemical is called Diisopropyl (Bromomethyl)boronate, and its systematic name is bis(1-methylethyl) (bromomethyl)boronate. With the molecular formula of C₇H₁₆BBrO₂ , its product categories are B (Classes of Boron Compounds); Boronic Acids Esters. The CAS registry number of this chemical is 137297-49-5. In addition, this chemical should be sealed in the cool place.

Other characteristics of the Diisopropyl (Bromomethyl)boronate can be summarised as followings: (1)ACD/LogP: 3.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.45; (4)ACD/LogD (pH 7.4): 3.45; (5)ACD/BCF (pH 5.5): 248.15; (6)ACD/BCF (pH 7.4): 248.15; (7)ACD/KOC (pH 5.5): 1801.93; (8)ACD/KOC (pH 7.4): 1801.93; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 18.46 Å²; (13)Index of Refraction: 1.422; (14)Molar Refractivity: 49.04 cm³; (15)Molar Volume: 192.6 cm³; (16)Polarizability: 19.44×10^-24cm³; (17)Surface Tension: 25.6 dyne/cm; (18)Density: 1.156 g/cm³; (19)Flash Point: 37.7 °C; (20)Enthalpy of Vaporization: 36.05 kJ/mol; (21)Boiling Point: 138.7 °C at 760 mmHg; (22)Vapour Pressure: 8.27 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: BrCB(OC(C)C)OC(C)C
2.InChI: InChI=1/C7H16BBrO2/c1-6(2)10-8(5-9)11-7(3)4/h6-7H,5H2,1-4H3
3.InChIKey: FNHYYZNZIWONBQ-UHFFFAOYAF

Product Name

DIISOPROPYL(BROMOMETHYL)BORONATE

Diisopropyl (Bromomethyl)boronate Specification

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