Phthalic Acid

CAS 88-99-3  ·  C8H6O4  ·  MW 166.13 g/mol

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3D model Phthalic Acid, CAS 88-99-3, molecular formula C8H6O4, molar mass 166.13 g/mol
About Phthalic Acid

Phthalic Acid is a chemical compound registered under number CAS 88-99-3, with the molecular formula C8H6O4, and a molar mass of 166.13 g/mol.

The molecule contains 18 atoms connected by 18 chemical bonds. The full systematic IUPAC name of this compound is phthalic acid. 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 = 0.7 (positive value, a lipophilic compound), polar surface area PSA = 74.6 Ų, 2 donors and 4 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 formulaC8H6O4
Masa molowa166.13 g/mol
IUPACphthalic acid
SMILESC1=CC=C(C(=C1)C(=O)O)C(=O)O
InChIKeyXNGIFLGASWRNHJ-UHFFFAOYSA-N
logP (XLogP3)0.7
PSA74.6 Ų
HBD / HBA2 / 4
PubChem CIDCID 1017 ↗
GHS safety

Signal word: Danger

GHS05
GHS05
GHS07
GHS07
GHS08
GHS08

H360 — Może działać szkodliwie na płodność lub na dziecko w łonie matki

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

20 articles · 10 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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📈 Publication timeline (20 articles)

1957: 1 articles19571991: 1 articles1999: 1 articles2001: 1 articles2003: 1 articles2004: 1 articles2012: 1 articles2013: 1 articles20132015: 2 articles2016: 1 articles2018: 1 articles2020: 1 articles2021: 1 articles2024: 1 articles2026: 5 articles2026

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Shuaihua Zhang, Qian Yang, Zhi Li et al. (2018) · Food Chemistry
AI Summary
The developed method, which combined the MIL-88(Fe)/GO coated fiber based SPME with gas chromatography-flame ionization detection (GC-FID), achieved low limits of detection and good linearity for the phthalic acid esters (PAEs) from various vegetable oil samples, indicating that the MIL/GO hybrid composite is a good coating material for the S PME of PAEs.
Cytowania: 67Influential: 2$ PaywallDOI ↗PubMed ↗

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

Synonyms
phthalic acid · 88-99-3 · 1,2-benzenedicarboxylic acid · o-phthalic acid · benzene-1,2-dicarboxylic acid · o-dicarboxybenzene · o-benzenedicarboxylic acid · Acide phtalique · Kyselina ftalova · ortho-phthalic acid · 6O7F7IX66E · NSC-5348 · DTXCID901484 · CHEBI:29069 · hydron;phthalate
Data sources
Related molecules
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📜 License & provenanceMolGod_License_1
Model
Phthalic Acid · 88-99-3
License
CC BY 4.0 International (source rights undetermined — not yet granted)
Attribution
MolGod Scientific
License & provenance record
Phthalic Acid (CAS 88-99-3) →
MolGod molecule record
Phthalic Acid →
Source data
PubChem CID 1017 ↗
SHA-256 (STL)
82a41cf07c6f5e6e58a7e17a6be1a1139218f90e985178cdb63320c6186058a0
Wikimedia Commons
not published yet
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