Pyrrolidine-3,4-diol

CAS 9046-10-0  ·  C4H9NO2  ·  MW 103.12 g/mol

Full record: Pyrrolidine-3,4-diol — Safety Data Sheet →

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3D model Pyrrolidine-3,4-diol, CAS 9046-10-0, molecular formula C4H9NO2, molar mass 103.12 g/mol

Model views

  • Pyrrolidine-3,4-diol (CAS 9046-10-0) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • Pyrrolidine-3,4-diol (CAS 9046-10-0) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • Pyrrolidine-3,4-diol (CAS 9046-10-0) – 2D structure, MolGod Viewer
    2D structure

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About Pyrrolidine-3,4-diol

Pyrrolidine-3,4-diol is a chemical compound registered under number CAS 9046-10-0, with the molecular formula C4H9NO2, and a molar mass of 103.12 g/mol.

The molecule contains 16 atoms connected by 16 chemical bonds. The full systematic IUPAC name of this compound is pyrrolidine-3,4-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 = -1.7 (negative value, a hydrophilic compound), polar surface area PSA = 52.5 Ų, 3 donors and 3 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 formulaC4H9NO2
Molar mass103.12 g/mol
IUPACpyrrolidine-3,4-diol
SMILESC1C(C(CN1)O)O
InChIKeyJCZPOYAMKJFOLA-UHFFFAOYSA-N
logP (XLogP3)-1.7
PSA52.5 Ų
HBD / HBA3 / 3
PubChem CIDCID 13329881 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H315 — Causes skin irritation

H319 — Causes serious eye irritation

H335 — May cause respiratory irritation

Scientific literature

Related literature

17 articles · 7 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (number of articles: 17)

2003: number of articles 120032005: number of articles 22006: number of articles 12009: number of articles 12010: number of articles 32012: number of articles 120122014: number of articles 12016: number of articles 12023: number of articles 42024: number of articles 22024

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
Pyrrolidine-3,4-diol · 473541-96-7 · RefChem:871085 · 819-919-0 · 9046-10-0 · Trans-3,4-pyrrolidinediol · 3,4-Pyrrolidinediol · 136779-52-7 · trans-pyrrolidine-3,4-diol · 3,4-dihydroxy-2h-pyrroline · SCHEMBL414574 · SCHEMBL978384 · JCZPOYAMKJFOLA-UHFFFAOYSA-N · MFCD18074103 · AKOS013013183
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
Pyrrolidine-3,4-diol · 9046-10-0
InChIKey
JCZPOYAMKJFOLA-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — Pyrrolidine-3,4-diol (CAS 9046-10-0)
License & provenance record
Pyrrolidine-3,4-diol (CAS 9046-10-0) →
MolGod molecule record
Pyrrolidine-3,4-diol →
Source data
PubChem CID 13329881 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
758cf6b153595b5e8cbd6b1aea249d977ac041c41f84904949054d62239b13cf
MD5 (STL)
aa363998d9c5aed455340a90b760ccd9
MolGod Identification Number
MG_659-928-868-81
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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