3-Hexyn-1-ol

CAS 1002-28-4  ·  C6H10O  ·  MW 98.14 g/mol

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3D model 3-Hexyn-1-ol, CAS 1002-28-4, molecular formula C6H10O, molar mass 98.14 g/mol
About 3-Hexyn-1-ol

3-Hexyn-1-ol is a chemical compound registered under number CAS 1002-28-4, with the molecular formula C6H10O, and a molar mass of 98.14 g/mol.

The molecule contains 17 atoms connected by 16 chemical bonds. The full systematic IUPAC name of this compound is hex-3-yn-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 = 1.1 (positive value, a lipophilic compound), polar surface area PSA = 20.2 Ų, 1 donors and 1 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 formulaC6H10O
Masa molowa98.14 g/mol
IUPAChex-3-yn-1-ol
SMILESCCC#CCCO
InChIKeyODEHKVYXWLXRRR-UHFFFAOYSA-N
logP (XLogP3)1.1
PSA20.2 Ų
HBD / HBA1 / 1
PubChem CIDCID 66083 ↗
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

15 articles · 2 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (15 articles)

1938: 1 articles19381963: 1 articles1973: 1 articles1985: 2 articles1990: 1 articles1997: 1 articles19972002: 1 articles2008: 1 articles2009: 1 articles2018: 4 articles2020: 1 articles2020

Bar height = number of articles per year. Hover dla szczegółów.

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

Synonyms
3-Hexyn-1-ol · hex-3-yn-1-ol · 3-Hexynol · 3-Hexyne-1-ol · X07KYI4GTH · EINECS 213-685-8 · UNII-X07KYI4GTH · AI3-37258 · RefChem:94039 · DTXCID6032481 · ODEHKVYXWLXRRR-UHFFFAOYSA-N · 1002-28-4 · MFCD00002957 · 3-Hexyn-1-ol, 98% · SCHEMBL487224
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
3-Hexyn-1-ol — CAS 1002-28-4

License: CC BY-SA 4.0 (source rights NIEUSTALONE — not yet granted for this model)

MolGod License & Provenance Record:
3-Hexyn-1-ol (CAS 1002-28-4) — License & Provenance

Source:
3-Hexyn-1-ol (CAS 1002-28-4) — MolGod molecule record

Source data: PubChem CID 66083

STL: Download 3D model (341 KB)

SHA-256: e955a9af6ef7f30e09236f1897c1179fa03e6364121305794cf1bafaf21c8392

Wikimedia Commons: not published yet

Source data: PubChem CID 66083

This licence applies to the MolGod-created STL mesh, not automatically to third-party source material.