Methylparaben

CAS 99-76-3  ·  C8H8O3  ·  MW 152.15 g/mol

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3D model Methylparaben, CAS 99-76-3, molecular formula C8H8O3, molar mass 152.15 g/mol
About Methylparaben

Methylparaben is a chemical compound registered under number CAS 99-76-3, with the molecular formula C8H8O3, and a molar mass of 152.15 g/mol.

The molecule contains 19 atoms connected by 19 chemical bonds. The full systematic IUPAC name of this compound is methyl 4-hydroxybenzoate. 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 = 2 (positive value, a lipophilic compound), polar surface area PSA = 46.5 Ų, 1 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 widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC8H8O3
Masa molowa152.15 g/mol
IUPACmethyl 4-hydroxybenzoate
SMILESCOC(=O)C1=CC=C(C=C1)O
InChIKeyLXCFILQKKLGQFO-UHFFFAOYSA-N
logP (XLogP3)2
PSA46.5 Ų
HBD / HBA1 / 3
PubChem CIDCID 7456 ↗
GHS safety

Signal word: Warning

GHS07
GHS07
GHS09
GHS09

H336 — Może wywoływać uczucie senności lub zawroty głowy

H402 — Działa szkodliwie na organizmy wodne

H411 — Działa toksycznie na organizmy wodne, powodując długotrwałe skutki

H412 — Działa szkodliwie na organizmy wodne, powodując długotrwałe skutki

Scientific literature

Related literature

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

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (11 articles)

2002: 1 articles20022021: 1 articles2022: 1 articles2024: 4 articles20242025: 3 articles2026: 1 articles2026

Bar height = number of articles per year. Hover dla szczegółów.

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

Synonyms
Methyl 4-hydroxybenzoate · METHYLPARABEN · 99-76-3 · Methyl paraben · Methyl p-hydroxybenzoate · Nipagin · Tegosept M · Moldex · Maseptol · Methyl parahydroxybenzoate · p-Hydroxybenzoic acid methyl ester · Preserval M · Preserval · Metaben · Methaben
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
Methylparaben — CAS 99-76-3

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

MolGod License & Provenance Record:
Methylparaben (CAS 99-76-3) — License & Provenance

Source:
Methylparaben (CAS 99-76-3) — MolGod molecule record

Source data: PubChem CID 7456

STL: Download 3D model (386 KB)

SHA-256: 62f1a0b60199466e872e287e39dcdc52c5649afa946efccb2b9a03db505132a1

Wikimedia Commons: not published yet

Source data: PubChem CID 7456

This licence applies to the MolGod-created STL mesh, not automatically to third-party source material.