Beta-Carotene (CAS 7235-40-7)

Beta-Carotene

CAS 7235-40-7  ·  C40H56  ·  MW 536.9 g/mol

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3D model Beta-Carotene, CAS 7235-40-7, molecular formula C40H56, molar mass 536.9 g/mol
About Beta-Carotene (CAS 7235-40-7)

Beta-Carotene (CAS 7235-40-7) is a chemical compound registered under number CAS 7235-40-7, with the molecular formula C40H56, and a molar mass of 536.9 g/mol.

The molecule contains 96 atoms connected by 97 chemical bonds. The full systematic IUPAC name of this compound is 1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene. 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 = 13.5 (positive value, a lipophilic compound), polar surface area PSA = 0 Ų, 0 donors and 0 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 interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Physicochemical properties
Molecular formulaC40H56
Molar mass536.9 g/mol
IUPAC1,3,3-trimethyl-2-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-18-(2,6,6-trimethylcyclohexen-1-yl)octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohexene
SMILESCC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(CCCC2(C)C)C)\C)\C)/C)/C
InChIKeyOENHQHLEOONYIE-JLTXGRSLSA-N
logP (XLogP3)13.5
PSA0 Ų
HBD / HBA0 / 0
PubChem CIDCID 5280489 ↗
Scientific literature

Related literature

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

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📈 Publication timeline (number of articles: 2)

1993: number of articles 119932025: number of articles 12025

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Data from PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary generated by Semantic Scholar TLDR. Articles marked with require paid access.

Synonyms
beta-carotene · 7235-40-7 · beta Carotene · Betacarotene · beta,beta-Carotene · Solatene · Carotaben · Provatene · all-trans-beta-Carotene · Serlabo · Food orange 5 · BetaVit · KPMK · Provatenol · Lucaratin
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Beta-Carotene (CAS 7235-40-7), C40H56 - 3D ball-and-stick molecular model, engraved element symbols (C H), MolGod STL previewDownload image

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Model
Beta-Carotene · 7235-40-7
InChIKey
OENHQHLEOONYIE-JLTXGRSLSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — Beta-Carotene (CAS 7235-40-7)
License & provenance record
Beta-Carotene (CAS 7235-40-7) →
MolGod molecule record
Beta-Carotene →
Source data
PubChem CID 5280489 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 2ea9a8c82836 · generated 2026-10-23
SHA-256 (STL)
771dd7eb51497f8eb6508ddd79772a1807a9252ee644ec33e6a204b031d49214
MD5 (STL)
d522d36d62ffd9c955897a2f0333e2dd
Model identifier
MG-STL-7235-40-7
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
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