2,2-Bis(bromomethyl)-1,3-propanediol

CAS 3296-90-0  ·  C5H10Br2O2  ·  MW 261.94 g/mol

Full record: 2,2-Bis(bromomethyl)-1,3-propanediol — Safety Data Sheet →

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3D model 2,2-Bis(bromomethyl)-1,3-propanediol, CAS 3296-90-0, molecular formula C5H10Br2O2, molar mass 261.94 g/mol

Model views

  • 2,2-Bis(bromomethyl)-1,3-propanediol (CAS 3296-90-0) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • 2,2-Bis(bromomethyl)-1,3-propanediol (CAS 3296-90-0) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • 2,2-Bis(bromomethyl)-1,3-propanediol (CAS 3296-90-0) – 2D structure, MolGod Viewer
    2D structure

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About 2,2-Bis(bromomethyl)-1,3-propanediol

2,2-Bis(bromomethyl)-1,3-propanediol is a chemical compound registered under number CAS 3296-90-0, with the molecular formula C5H10Br2O2, and a molar mass of 261.94 g/mol.

The molecule contains 19 atoms connected by 18 chemical bonds. The full systematic IUPAC name of this compound is 2,2-bis(bromomethyl)propane-1,3-diol. 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 = 0.5 (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 interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Physicochemical properties
Molecular formulaC5H10Br2O2
Molar mass261.94 g/mol
IUPAC2,2-bis(bromomethyl)propane-1,3-diol
SMILESC(C(CO)(CBr)CBr)O
InChIKeyCHUGKEQJSLOLHL-UHFFFAOYSA-N
logP (XLogP3)0.5
PSA40.5 Ų
HBD / HBA2 / 2
PubChem CIDCID 18692 ↗
GHS safety

Signal word: Danger

GHS08
GHS08

H350 — May cause cancer

H340 — May cause genetic defects

Scientific literature

Related literature

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

Filters:Export:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (number of articles: 6)

1996: number of articles 119962000: number of articles 12005: number of articles 220052010: number of articles 22010

Bar height = number of articles in a given year. Hover over a bar to see details.

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

Synonyms
3296-90-0 · 2,2-Bis(bromomethyl)propane-1,3-diol · 2,2-BIS(BROMOMETHYL)-1,3-PROPANEDIOL · Pentaerythritol dibromide · Dibromoneopentyl glycol · Dibromopentaerythritol · 1,3-Propanediol, 2,2-bis(bromomethyl)- · Pentaerythritol dibromohydrin · FR 1138 · NCI-C55516 · 1,3-Dibromo-2,2-dimethylolpropane · 2,2-Dibromomethyl-1,3-propanediol · 1,3-Dibromo-2,2-dihydroxymethylpropane · Fr 522 · 4ZHG182S25
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
2,2-Bis(bromomethyl)-1,3-propanediol · 3296-90-0
InChIKey
CHUGKEQJSLOLHL-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — 2,2-Bis(bromomethyl)-1,3-propanediol (CAS 3296-90-0)
License & provenance record
2,2-Bis(bromomethyl)-1,3-propanediol (CAS 3296-90-0) →
MolGod molecule record
2,2-Bis(bromomethyl)-1,3-propanediol →
Source data
PubChem CID 18692 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
e68f8e2ee6fe99f9db171b9d2021bc8f43368eda4be9d6b6dc0b5986a0d841ba
MD5 (STL)
eb17fda1c41faa225cd30980f3cc5bf2
MolGod Identification Number
MG_590-582-830-64
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
not published yet
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