2-tert-Butylcyclohexanol, mixture of isomers - CAS 13491-79-7
Catalog: |
BB008035 |
Product Name: |
2-tert-Butylcyclohexanol, mixture of isomers |
CAS: |
13491-79-7 |
Synonyms: |
2-tert-butylcyclohexan-1-ol |
IUPAC Name: | 2-tert-butylcyclohexan-1-ol |
Description: | 2-tert-Butylcyclohexanol, mixture of isomers (CAS# 13491-79-7 ) is a useful research chemical. |
Molecular Weight: | 156.27 |
Molecular Formula: | C10H20O |
Canonical SMILES: | CC(C)(C)C1CCCCC1O |
InChI: | InChI=1S/C10H20O/c1-10(2,3)8-6-4-5-7-9(8)11/h8-9,11H,4-7H2,1-3H3 |
InChI Key: | DLTWBMHADAJAAZ-UHFFFAOYSA-N |
Boiling Point: | 209 °C |
Melting Point: | 43-46°C |
Flash Point: | 79°C |
Density: | 0.9 g/cm3 |
Solubility: | water, 278 mg/L @ 25 °C (est) |
Appearance: | Solid |
MDL: | MFCD00001472 |
LogP: | 2.58360 |
Refractive Index: | 1.471 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113372191-A | Preparation method of tert-butyl cyclohexanol | 20210517 |
CN-112266823-A | Essence for soap | 20200911 |
JP-2021138856-A | Overcoat and printed matter | 20200306 |
CN-111167515-A | Monomolecular heteropoly acid inlaid honeycomb-shaped carbon material loaded nano metal catalyst and preparation method and application thereof | 20200221 |
CN-111167516-A | Porous carbon supported monomolecular heteropoly acid catalyst and preparation method and application thereof | 20200221 |
Complexity: | 123 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.151415257 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.151415257 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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