(S)-1,2,3,4-tetrahydro-1-naphthoic acid

CAS 85977-52-2  ·  C11H12O2  ·  MW 176.21 g/mol

Full record: (S)-1,2,3,4-tetrahydro-1-naphthoic acid — Safety Data Sheet →

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3D model (S)-1,2,3,4-tetrahydro-1-naphthoic acid, CAS 85977-52-2, molecular formula C11H12O2, molar mass 176.21 g/mol

Model views

  • (S)-1,2,3,4-tetrahydro-1-naphthoic acid (CAS 85977-52-2) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • (S)-1,2,3,4-tetrahydro-1-naphthoic acid (CAS 85977-52-2) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • (S)-1,2,3,4-tetrahydro-1-naphthoic acid (CAS 85977-52-2) – 2D structure, MolGod Viewer
    2D structure

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(S)-1,2,3,4-tetrahydro-1-naphthoic acid (CAS 85977-52-2), C11H12O2 - 3D ball-and-stick molecular model, MolGod STL previewDownload image

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Download 3D model: (S)-1,2,3,4-tetrahydro-1-naphthoic acid, C11H12O2, CAS 85977-52-2 · NORMAL · 531 KB

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About (S)-1,2,3,4-tetrahydro-1-naphthoic acid

(S)-1,2,3,4-tetrahydro-1-naphthoic acid is a chemical compound registered under number CAS 85977-52-2, with the molecular formula C11H12O2, and a molar mass of 176.21 g/mol.

The molecule contains 25 atoms connected by 26 chemical bonds. The full systematic IUPAC name of this compound is (1S)-1,2,3,4-tetrahydronaphthalene-1-carboxylic 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 = 2.4 (positive value, a lipophilic compound), polar surface area PSA = 37.3 Ų, 1 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 formulaC11H12O2
Molar mass176.21 g/mol
IUPAC(1S)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
SMILESC1C[C@@H](C2=CC=CC=C2C1)C(=O)O
InChIKeyVDLWTJCSPSUGOA-JTQLQIEISA-N
logP (XLogP3)2.4
PSA37.3 Ų
HBD / HBA1 / 2
PubChem CIDCID 24820460 ↗
Scientific literature

Brak articles naukowych dla CAS 85977-52-2 w PubMed / OpenAlex / Semantic Scholar.

Synonyms
85977-52-2 · (S)-1,2,3,4-tetrahydro-1-naphthoic acid · (S)-1,2,3,4-tetrahedro-naphthoic acid · (1S)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid · MFCD07368365 · (S)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid · SCHEMBL2796237 · AKOS015833089 · AC-6928 · (S)-1,2,3,4-tetrahydro-1-naphthoicacid · H11405 · (S)-1,2,3,4-tetrahydro-naphthalene-1-carboxylic acid · (S)-1,2,3,4-Tetrahydronaphthoic acid · (1S)-tetralin-1-carboxylic acid · (S)-1,2,3,4-tetrahydro-naphthoic acid
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
(S)-1,2,3,4-tetrahydro-1-naphthoic acid · 85977-52-2
InChIKey
VDLWTJCSPSUGOA-JTQLQIEISA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — (S)-1,2,3,4-tetrahydro-1-naphthoic acid (CAS 85977-52-2)
License & provenance record
(S)-1,2,3,4-tetrahydro-1-naphthoic acid (CAS 85977-52-2) →
MolGod molecule record
(S)-1,2,3,4-tetrahydro-1-naphthoic acid →
Source data
PubChem CID 24820460 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
150bc279be724ba0fe989f793c96f3cfb5327d8f5c734f2c585c9279154401b5
MD5 (STL)
861ab1415ac9fb89c765b23ded9451b1
MolGod Identification Number
MG_199-562-772-50
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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