Sorbitan monododecanoate

CAS 1338-39-2  ·  C18H34O6  ·  MW 346.5 g/mol

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3D model Sorbitan monododecanoate, CAS 1338-39-2, molecular formula C18H34O6, molar mass 346.5 g/mol
About Sorbitan monododecanoate

Sorbitan monododecanoate is a chemical compound registered under number CAS 1338-39-2, with the molecular formula C18H34O6, and a molar mass of 346.5 g/mol.

The molecule contains 58 atoms connected by 58 chemical bonds. The full systematic IUPAC name of this compound is [(2R)-2-[(2R,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] dodecanoate. 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 = 3.7 (positive value, a lipophilic compound), polar surface area PSA = 96.2 Ų, 3 donors and 6 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 formulaC18H34O6
Masa molowa346.5 g/mol
IUPAC[(2R)-2-[(2R,3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] dodecanoate
SMILESCCCCCCCCCCCC(=O)OC[C@H]([C@@H]1[C@@H]([C@H](CO1)O)O)O
InChIKeyLWZFANDGMFTDAV-BURFUSLBSA-N
logP (XLogP3)3.7
PSA96.2 Ų
HBD / HBA3 / 6
PubChem CIDCID 11046239 ↗
Scientific literature

Related literature

2 articles · 0 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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2022: 1 articles20222023: 1 articles2023

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

Synonyms
Sorbitan monolaurate · Sorbitan laurate · Sorbitan, monododecanoate · Anhydrosorbitol monolaurate · Laurate de sorbitan · Arlacel 20 · Sorbitani lauras · Glycomul L · Glycomul LC · Alkamuls SML · Armotan ML · Dehymuls SML · Lonzest SML · Texnol SPT · Montane 20
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
Sorbitan monododecanoate — CAS 1338-39-2

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

MolGod License & Provenance Record:
Sorbitan monododecanoate (CAS 1338-39-2) — License & Provenance

Source:
Sorbitan monododecanoate (CAS 1338-39-2) — MolGod molecule record

Source data: PubChem CID 11046239

STL: Download 3D model (1 MB)

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Source data: PubChem CID 11046239

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