Bromocyclohexane - CAS 108-85-0
Catalog: |
BB002353 |
Product Name: |
Bromocyclohexane |
CAS: |
108-85-0 |
Synonyms: |
bromocyclohexane |
IUPAC Name: | bromocyclohexane |
Description: | Bromocyclohexane (CAS# 108-85-0) is s used in the synthetic preparation and regioselective bromination of sp3 C-H bonds by organophotoredox catalysis. |
Molecular Weight: | 163.06 |
Molecular Formula: | C6H11Br |
Canonical SMILES: | C1CCC(CC1)Br |
InChI: | InChI=1S/C6H11Br/c7-6-4-2-1-3-5-6/h6H,1-5H2 |
InChI Key: | AQNQQHJNRPDOQV-UHFFFAOYSA-N |
Boiling Point: | 166-167 °C |
Melting Point: | -57 °C |
Purity: | 98 % |
Density: | 1.324 g/cm3 |
Appearance: | Colourless liquid |
Storage: | Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00003819 |
LogP: | 2.71400 |
Vapor Pressure: | 3.62 [mmHg] |
GHS Hazard Statement: | H227 (16.67%): Combustible liquid [Warning Flammable liquids] |
Precautionary Statement: | P210, P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P391, P403+P233, P403+P235, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113416206-A | Spiro compound, preparation, organic electroluminescent diode and display device | 20210823 |
CN-113512043-A | Organic compound, preparation, organic light-emitting device, and display or lighting device | 20210817 |
CN-113416536-A | Host-guest composition and organic electroluminescent element comprising same | 20210609 |
CN-113416537-A | Host-guest composition and organic electroluminescent element comprising same | 20210609 |
CN-113421982-A | Host-guest composition and organic electroluminescent element comprising same | 20210609 |
PMID | Publication Date | Title | Journal |
22697415 | 20120706 | Nickel-catalyzed reductive coupling of aryl halides with secondary alkyl bromides and allylic acetate | Organic letters |
22381789 | 20120601 | Conformational mobility of small molecules in glass-forming solutions studied by FTIR spectroscopy | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
21922569 | 20111017 | Iron-catalyzed coupling of aryl Grignard reagents with alkyl halides: a competitive Hammett study | Chemistry (Weinheim an der Bergstrasse, Germany) |
21700292 | 20110915 | Electrophoresis of concentrated colloidal dispersions in low-polar solvents | Journal of colloid and interface science |
21057680 | 20110121 | Characterization of room temperature phosphorescence of propranolol and the chiral discrimination between R- and S-isomers | The Analyst |
Complexity: | 46.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 162.00441 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 162.00441 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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