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Name |
Tricyclo[3.3.1.13,7]decane,1-bromo-3-methyl- |
EINECS | N/A |
CAS No. | 702-77-2 | Density | 1.403 g/cm3 |
PSA | 0.00000 | LogP | 3.74020 |
Solubility | N/A | Melting Point |
N/A |
Formula | C11H17Br | Boiling Point | 243.6 °C at 760 mmHg |
Molecular Weight | 229.16 | Flash Point | 103.7 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
NSC 255329;Adamantane,1-bromo-3-methyl- (7CI,8CI);1-Bromo-3-methyladamantane;1-Methyl-3-bromoadamantane; |
Article Data | 9 |
This chemical is called Tricyclo[3.3.1.13,7]decane,1-bromo-3-methyl-, and its systematic name is 1-bromo-3-methyltricyclo[3.3.1.13,7]decane. With the molecular formula of C11H17Br, its molecular weight is 229.16. The CAS registry number of this chemical is 702-77-2.
Other characteristics of the Tricyclo[3.3.1.13,7]decane,1-bromo-3-methyl- can be summarised as followings: (1)ACD/LogP: 4.51; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Index of Refraction: 1.582; (7)Molar Refractivity: 54.51 cm3; (8)Molar Volume: 163.3 cm3; (9)Polarizability: 21.61×10-24cm3; (10)Surface Tension: 45.1 dyne/cm; (11)Density: 1.403 g/cm3; (12)Flash Point: 103.7 °C; (13)Enthalpy of Vaporization: 46.11 kJ/mol; (14)Boiling Point: 243.6 °C at 760 mmHg; (15)Vapour Pressure: 0.0497 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: BrC12CC3CC(C1)(CC(C2)C3)C
2.InChI: InChI=1/C11H17Br/c1-10-3-8-2-9(4-10)6-11(12,5-8)7-10/h8-9H,2-7H2,1H3
3.InChIKey: MXAYGTASSPYUJB-UHFFFAOYAG