Bicyclo[2.2.1]heptane,2-bromo-1,7,7-trimethyl- supplier

Name
BornylBromide
EINECS
CAS No. 4443-48-5
Article Data2
CAS DataBase
Density 1.25 g/cm³
Solubility
Melting Point
Formula C₁₀H₁₇Br
Boiling Point 208.5 °C at 760 mmHg
Molecular Weight 217.149
Flash Point 91.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Bornane,2-bromo- (6CI,8CI);
PSA 0.00000
LogP 3.59610

Bicyclo[2.2.1]heptane,2-bromo-1,7,7-trimethyl- Specification

The Bicyclo[2.2.1]heptane,2-bromo-1,7,7-trimethyl-, with the CAS registry number 4443-48-5, is also known as 2-Bromobornane. This chemical's molecular formula is C₁₀H₁₇Br and molecular weight is 217.146. What's more, its IUPAC name is 3-Bromo-4,7,7-trimethylbicyclo[2.2.1]heptane.

Physical properties about Bicyclo[2.2.1]heptane,2-bromo-1,7,7-trimethyl- are: (1)ACD/LogP: 4.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.57; (4)ACD/LogD (pH 7.4): 4.57; (5)ACD/BCF (pH 5.5): 1761.36; (6)ACD/BCF (pH 7.4): 1761.36; (7)ACD/KOC (pH 5.5): 7327.83; (8)ACD/KOC (pH 7.4): 7327.83; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å²; (13)Index of Refraction: 1.514; (14)Molar Refractivity: 52.05 cm³; (15)Molar Volume: 172.7 cm³; (16)Polarizability: 20.63×10^-24cm³; (17)Surface Tension: 32.6 dyne/cm; (18)Density: 1.257 g/cm³; (19)Flash Point: 91.4 °C; (20)Enthalpy of Vaporization: 42.67 kJ/mol; (21)Boiling Point: 208.5 °C at 760 mmHg; (22)Vapour Pressure: 0.307 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: BrC2CC1CCC2(C)C1(C)C
(2) InChI: InChI=1/C10H17Br/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8H,4-6H2,1-3H3
(3) InChIKey: OTOQMOVZIUGCQE-UHFFFAOYAE

Product Name

BornylBromide

Bicyclo[2.2.1]heptane,2-bromo-1,7,7-trimethyl- Specification

Related Products

Hot Products