(1,1'-Bicyclohexyl)-4,4'-diol

CAS 20601-38-1  ·  C12H22O2  ·  MW 198.30 g/mol

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3D model (1,1'-Bicyclohexyl)-4,4'-diol, CAS 20601-38-1, molecular formula C12H22O2, molar mass 198.30 g/mol
About (1,1'-Bicyclohexyl)-4,4'-diol

(1,1'-Bicyclohexyl)-4,4'-diol is a chemical compound registered under number CAS 20601-38-1, with the molecular formula C12H22O2, and a molar mass of 198.30 g/mol.

The molecule contains 36 atoms connected by 37 chemical bonds. The full systematic IUPAC name of this compound is 4-(4-hydroxycyclohexyl)cyclohexan-1-ol. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 1.9 (positive value, a lipophilic compound), polar surface area PSA = 40.5 Ų, 2 donors and 2 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC12H22O2
Masa molowa198.30 g/mol
IUPAC4-(4-hydroxycyclohexyl)cyclohexan-1-ol
SMILESC1CC(CCC1C2CCC(CC2)O)O
InChIKeyMZXNOAWIRQFYDB-UHFFFAOYSA-N
logP (XLogP3)1.9
PSA40.5 Ų
HBD / HBA2 / 2
PubChem CIDCID 88608 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

1 articles · 1 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
20601-38-1 · [1,1'-Bicyclohexyl]-4,4'-diol · (1,1'-Bicyclohexyl)-4,4'-diol · Bicyclohexylacetophenone · Dicyclohexyl-4,4'-diol · EINECS 243-908-4 · RefChem:68025 · DTXCID1097107 · 243-908-4 · MZXNOAWIRQFYDB-UHFFFAOYSA-N · [1,1'-Bi(cyclohexane)]-4,4'-diol · 4,4'-Bicyclohexanol · 4-(4-hydroxycyclohexyl)cyclohexan-1-ol · MFCD00012056 · Oprea1_436558
Data sources
Related molecules
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