1-Acetylcyclohexanol - CAS 1123-27-9
Catalog: |
BB002943 |
Product Name: |
1-Acetylcyclohexanol |
CAS: |
1123-27-9 |
Synonyms: |
1-(1-hydroxycyclohexyl)ethanone; 1-(1-hydroxycyclohexyl)ethanone |
IUPAC Name: | 1-(1-hydroxycyclohexyl)ethanone |
Description: | 1-Acetylcyclohexanol (CAS# 1123-27-9) is a useful research chemical compound. |
Molecular Weight: | 142.20 |
Molecular Formula: | C8H14O2 |
Canonical SMILES: | CC(=O)C1(CCCCC1)O |
InChI: | InChI=1S/C8H14O2/c1-7(9)8(10)5-3-2-4-6-8/h10H,2-6H2,1H3 |
InChI Key: | JKAKPUWJSRMKFH-UHFFFAOYSA-N |
Boiling Point: | 235.5 °C at 760 mmHg |
Flash Point: | 95.9°C |
Purity: | N/A |
Density: | 1.068 g/cm3 |
Solubility: | water, 1.532e+004 mg/L @ 25 °C (est) |
Appearance: | Solid |
Storage: | Sealed in dry, Room Temperature |
MDL: | MFCD00019352 |
LogP: | 1.27060 |
Refractive Index: | 1.488 |
GHS Hazard Statement: | H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P310, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
TW-202014190-A | Method for treating lymphoma | 20180504 |
CN-109776511-A | A kind of N- substituted imidazole formate ester derivative and application thereof | 20180130 |
WO-2019149228-A1 | Substituted imidazole formate derivative and use thereof | 20180130 |
EP-3747869-A1 | Substituted imidazole formate derivative and use thereof | 20180130 |
US-2020369621-A1 | Substituted imidazolecarboxylate derivatives and the use thereof | 20180130 |
Complexity: | 134 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 142.099379685 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 142.099379685 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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