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CAS No.: | 1556-09-8 |
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Name: | CYCLOOCTYL BROMIDE |
Article Data: | 30 |
Molecular Structure: | |
Formula: | C8H15Br |
Molecular Weight: | 191.111 |
Synonyms: | Bromocyclooctane;Cyclooctyl bromide;NSC 226433; |
EINECS: | 216-310-6 |
Density: | 1.222 g/cm3 |
Boiling Point: | 208.8 °C at 760 mmHg |
Flash Point: | 83.4 °C |
Safety: | 24/25 |
PSA: | 0.00000 |
LogP: | 3.49420 |
The Cyclooctane, bromo-, with the CAS registry number 1556-09-8, is also known as NSC226433. Its EINECS registry number is 216-310-6. This chemical's molecular formula is C8H15Br and molecular weight is 191.1087. Its IUPAC name is called bromocyclooctane. When you are using this chemical, please be cautious about it. You must avoid contacting it with skin and eyes. What's more, the product should be sealed and stored in cool, dry and well-ventilated place.
Physical properties of Cyclooctane, bromo-: (1)ACD/LogP: 4.34; (2)ACD/LogD (pH 5.5): 4.34; (3)ACD/LogD (pH 7.4): 4.34; (4)ACD/BCF (pH 5.5): 1162.85; (5)ACD/BCF (pH 7.4): 1162.85; (6)ACD/KOC (pH 5.5): 5443.8; (7)ACD/KOC (pH 7.4): 5443.8; (8)Index of Refraction: 1.483; (9)Molar Refractivity: 44.67 cm3; (10)Molar Volume: 156.2 cm3; (11)Surface Tension: 31.9 dyne/cm; (12)Density: 1.222 g/cm3; (13)Flash Point: 83.4 °C; (14)Enthalpy of Vaporization: 42.69 kJ/mol; (15)Boiling Point: 208.8 °C at 760 mmHg; (16)Vapour Pressure: 0.302 mmHg at 25°C.
Uses of Cyclooctane, bromo-: it can be used to produce iodo-cyclooctane at temperature of 70 °C. This reaction will need reagents aq. HI, hexadecyltributylphosphonium bromide with reaction time of 1.5 hours. The yield is about 88%.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCCC(CCC1)Br
(2)InChI: InChI=1S/C8H15Br/c9-8-6-4-2-1-3-5-7-8/h8H,1-7H2
(3)InChIKey: KFKLBMQLKLKHLU-UHFFFAOYSA-N