Methyl 1-naphthylacetate

CAS 2876-78-0  ·  C13H12O2  ·  MW 200.23 g/mol

Full record: Methyl 1-naphthylacetate — Safety Data Sheet →

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3D model Methyl 1-naphthylacetate, CAS 2876-78-0, molecular formula C13H12O2, molar mass 200.23 g/mol

Model views

  • Methyl 1-naphthylacetate (CAS 2876-78-0) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • Methyl 1-naphthylacetate (CAS 2876-78-0) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • Methyl 1-naphthylacetate (CAS 2876-78-0) – 2D structure, MolGod Viewer
    2D structure

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About Methyl 1-naphthylacetate

Methyl 1-naphthylacetate is a chemical compound registered under number CAS 2876-78-0, with the molecular formula C13H12O2, and a molar mass of 200.23 g/mol.

The molecule contains 27 atoms connected by 28 chemical bonds. The full systematic IUPAC name of this compound is methyl 2-naphthalen-1-ylacetate. 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 = 3.1 (positive value, a lipophilic compound), polar surface area PSA = 26.3 Ų, 0 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 formulaC13H12O2
Molar mass200.23 g/mol
IUPACmethyl 2-naphthalen-1-ylacetate
SMILESCOC(=O)CC1=CC=CC2=CC=CC=C21
InChIKeyYGGXZTQSGNFKPJ-UHFFFAOYSA-N
logP (XLogP3)3.1
PSA26.3 Ų
HBD / HBA0 / 2
PubChem CIDCID 17891 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H302 — Harmful if swallowed

Scientific literature

Related literature

2 articles · 0 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (number of articles: 2)

2004: number of articles 120042012: number of articles 12012

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
Methyl 1-naphthaleneacetate · 2876-78-0 · Methyl 1-naphthylacetate · Hormonit · Kartofin · 1-NAPHTHALENEACETIC ACID, METHYL ESTER · M 1 (Growth regulator) · Latka M-1 · Methyl alpha-naphthylacetate · Methyl naphthaleneacetic acid · Latka M-1 [Czech] · Methyl 1-naphthaleneacetic acid · NSC 122030 · methyl 1-naphthalenylacetate · Naphthaleneacetic acid methyl ester
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
Methyl 1-naphthylacetate · 2876-78-0
InChIKey
YGGXZTQSGNFKPJ-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — Methyl 1-naphthylacetate (CAS 2876-78-0)
License & provenance record
Methyl 1-naphthylacetate (CAS 2876-78-0) →
MolGod molecule record
Methyl 1-naphthylacetate →
Source data
PubChem CID 17891 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
b698db1479c55c57823e9b36203e196b0c5b4dee8bacf71d225431a6f40a7e4d
MD5 (STL)
ea52e8685dfe96470f6544d989fa9f0c
MolGod Identification Number
MG_231-340-201-42
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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