4-tert-Butylcyclohexanol, mixture of cis and trans - CAS 98-52-2
Catalog: |
BB042176 |
Product Name: |
4-tert-Butylcyclohexanol, mixture of cis and trans |
CAS: |
98-52-2 |
Synonyms: |
4-tert-butylcyclohexan-1-ol |
IUPAC Name: | 4-tert-butylcyclohexan-1-ol |
Description: | 4-tert-Butylcyclohexanol, mixture of cis and trans (CAS# 98-52-2) is a useful research chemical. |
Molecular Weight: | 156.27 |
Molecular Formula: | C10H20O |
Canonical SMILES: | CC(C)(C)C1CCC(CC1)O |
InChI: | InChI=1S/C10H20O/c1-10(2,3)8-4-6-9(11)7-5-8/h8-9,11H,4-7H2,1-3H3 |
InChI Key: | CCOQPGVQAWPUPE-UHFFFAOYSA-N |
Boiling Point: | 110-115 °C (15 mmHg) |
Melting Point: | 60-69 °C |
Flash Point: | 105°C |
Purity: | 95 % |
Density: | 0.92 g/cm3 |
Appearance: | White powder. |
Storage: | Keep container closed when not in use. Store in a cool, dry, well-ventilated area away from incompatible substances. |
MDL: | MFCD00001473 |
LogP: | 2.58360 |
Refractive Index: | 1.447 |
Stability: | Stable under normal temperatures and pressures. |
Vapor Pressure: | 0.005 [mmHg] |
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-113476368-A | Soothing and repairing composition and preparation method thereof | 20210727 |
CN-113332160-A | Cosmetic composition for conditioning peritrichotic skin | 20210722 |
CN-113372191-A | Preparation method of tert-butyl cyclohexanol | 20210517 |
CN-113203835-A | Method for evaluating soothing effect of cosmetic raw material | 20210430 |
CN-112972312-A | Glacier mud mask formula | 20210412 |
PMID | Publication Date | Title | Journal |
23929722 | 20131101 | Nonivamide, a capsaicin analog, increases dopamine and serotonin release in SH-SY5Y cells via a TRPV1-independent pathway | Molecular nutrition & food research |
22806854 | 20120201 | The antimicrobial profile of extracts of a Phormidium-like cyanobacterium changes with phosphate levels | World journal of microbiology & biotechnology |
21658385 | 20110930 | Cyclohexanol analogues are positive modulators of GABA(A) receptor currents and act as general anaesthetics in vivo | European journal of pharmacology |
20626462 | 20101101 | Inhibition of TRPV1 for the treatment of sensitive skin | Experimental dermatology |
19913605 | 20100215 | Comparison of relative binding affinities to fish and mammalian estrogen receptors: the regulatory implications | Toxicology letters |
Complexity: | 115 |
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: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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