(2H14)Methylcyclohexane

CAS 10120-28-2  ·  C7H14  ·  MW 112.27 g/mol

Full record: (2H14)Methylcyclohexane — Safety Data Sheet →

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3D model (2H14)Methylcyclohexane, CAS 10120-28-2, molecular formula C7H14, molar mass 112.27 g/mol

Model views

  • (2H14)Methylcyclohexane (CAS 10120-28-2) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • (2H14)Methylcyclohexane (CAS 10120-28-2) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • (2H14)Methylcyclohexane (CAS 10120-28-2) – 2D structure, MolGod Viewer
    2D structure

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About (2H14)Methylcyclohexane

(2H14)Methylcyclohexane is a chemical compound registered under number CAS 10120-28-2, with the molecular formula C7H14, and a molar mass of 112.27 g/mol.

The molecule contains 21 atoms connected by 21 chemical bonds. The full systematic IUPAC name of this compound is 1,1,2,2,3,3,4,4,5,5,6-undecadeuterio-6-(trideuteriomethyl)cyclohexane. 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 = 3.6 (positive value, a lipophilic compound), polar surface area PSA = 0 Ų, 0 donors and 0 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 formulaC7H14
Molar mass112.27 g/mol
IUPAC1,1,2,2,3,3,4,4,5,5,6-undecadeuterio-6-(trideuteriomethyl)cyclohexane
SMILES[2H]C1(C(C(C(C(C1([2H])[2H])([2H])[2H])([2H])C([2H])([2H])[2H])([2H])[2H])([2H])[2H])[2H]
InChIKeyUAEPNZWRGJTJPN-OBYKGMMLSA-N
logP (XLogP3)3.6
PSA0 Ų
HBD / HBA0 / 0
PubChem CIDCID 524602 ↗
GHS safety

Signal word: Danger

GHS02
GHS02
GHS07
GHS07
GHS09
GHS09

H225 — Highly flammable liquid and vapour

H304 — May be fatal if swallowed and enters airways

H315 — Causes skin irritation

H336 — May cause drowsiness or dizziness

H411 — Toxic to aquatic life with long lasting effects

Scientific literature

Related literature

13 articles · 3 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (number of articles: 13)

1967: number of articles 119671997: number of articles 11999: number of articles 22002: number of articles 12007: number of articles 120072011: number of articles 12014: number of articles 12017: number of articles 12024: number of articles 12024

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
Methylcyclohexane-d14 · (2H14)Methylcyclohexane · Cyclohexane-d11, methyl-d3- · [2H14]methylcyclohexane · EINECS 233-325-3 · RefChem:396715 · 233-325-3 · 10120-28-2 · 1,1,2,2,3,3,4,4,5,5,6-undecadeuterio-6-(trideuteriomethyl)cyclohexane · Cyclohexane-1,1,2,2,3,3,4,4,5,5,6-d11, 6-(methyl-d3)- · MFCD00001498 · Methylcyclohexane-d14 (reagent grade) · Methylcyclohexane-d14 (d, 99.5%) · Methylcyclohexane-d?? · SCHEMBL1330951
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
(2H14)Methylcyclohexane · 10120-28-2
InChIKey
UAEPNZWRGJTJPN-OBYKGMMLSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — (2H14)Methylcyclohexane (CAS 10120-28-2)
License & provenance record
(2H14)Methylcyclohexane (CAS 10120-28-2) →
MolGod molecule record
(2H14)Methylcyclohexane →
Source data
PubChem CID 524602 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
d0367bc8130848502e7ae2fb6b469f898d8aa13680fa40bb280f2bb56967738e
MD5 (STL)
9da80c2a23c9a6bad8e250977ee0cfce
MolGod Identification Number
MG_314-606-368-15
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
STL · PNG
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This 3D model is also published on: Zenodo (DOI 10.5281/zenodo.23586676) · Wikimedia Commons
Included in datasets: Hugging Face · OSF project index
Source structure: PubChem (CID 524602)
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