(R)-((2-(Bromomethyl)-3-methylbutoxy)methyl)benzene supplier

Name
(R)-((2-(Bromomethyl)-3-methylbutoxy)methyl)benzene
EINECS
CAS No. 179993-02-3
Article Data1
CAS DataBase
Density 1.204 g/cm³
Solubility
Melting Point
Formula C₁₃H₁₉BrO
Boiling Point 293.9 °C at 760 mmHg
Molecular Weight 271.197
Flash Point 130.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzene,[[2-(bromomethyl)-3-methylbutoxy]methyl]-, (R)-;
PSA 9.23000
LogP 3.87030

(R)-((2-(Bromomethyl)-3-methylbutoxy)methyl)benzene Specification

The (R)-((2-(Bromomethyl)-3-methylbutoxy)methyl)benzene, with the CAS registry number 179993-02-3, is also known as Benzyl (2R)-2-(bromomethyl)-3-methylbutyl ether. This chemical's molecular formula is C₁₃H₁₉BrO and molecular weight is 271.19. Its systematic name is called benzene, [[[(2R)-2-(bromomethyl)-3-methylbutyl]oxy]methyl]-.

Physical properties of (R)-((2-(Bromomethyl)-3-methylbutoxy)methyl)benzene: (1)ACD/LogP: 4.48; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.48; (4)ACD/LogD (pH 7.4): 4.48; (5)ACD/BCF (pH 5.5): 1482.95; (6)ACD/BCF (pH 7.4): 1482.95; (7)ACD/KOC (pH 5.5): 6478.75; (8)ACD/KOC (pH 7.4): 6478.75; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Index of Refraction: 1.519; (13)Molar Refractivity: 68.36 cm³; (14)Molar Volume: 225 cm³; (15)Surface Tension: 35.4 dyne/cm; (16)Density: 1.204 g/cm³; (17)Flash Point: 130.2 °C; (18)Enthalpy of Vaporization: 51.22 kJ/mol; (19)Boiling Point: 293.9 °C at 760 mmHg; (20)Vapour Pressure: 0.00293 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(C)[C@H](COCc1ccccc1)CBr
(2)InChI: InChI=1/C13H19BrO/c1-11(2)13(8-14)10-15-9-12-6-4-3-5-7-12/h3-7,11,13H,8-10H2,1-2H3/t13-/m0/s1
(3)InChIKey: ADRDHWGOETUEBH-ZDUSSCGKBD

Product Name

(R)-((2-(Bromomethyl)-3-methylbutoxy)methyl)benzene

(R)-((2-(Bromomethyl)-3-methylbutoxy)methyl)benzene Specification

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