Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)-

CAS 19692-45-6  ·  C11H15Cl  ·  MW 182.69 g/mol

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3D model Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)-, CAS 19692-45-6, molecular formula C11H15Cl, molar mass 182.69 g/mol
About Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)-

Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)- is a chemical compound registered under number CAS 19692-45-6, with the molecular formula C11H15Cl, and a molar mass of 182.69 g/mol.

The molecule contains 27 atoms connected by 27 chemical bonds. The full systematic IUPAC name of this compound is 1-tert-butyl-4-(chloromethyl)benzene. 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 = 4 (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 widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC11H15Cl
Masa molowa182.69 g/mol
IUPAC1-tert-butyl-4-(chloromethyl)benzene
SMILESCC(C)(C)C1=CC=C(C=C1)CCl
InChIKeyWAXIFMGAKWIFDQ-UHFFFAOYSA-N
logP (XLogP3)4
PSA0 Ų
HBD / HBA0 / 0
PubChem CIDCID 88198 ↗
GHS safety

Signal word: Danger

GHS05
GHS05
GHS07
GHS07

H314 — Powoduje poważne oparzenia skóry oraz uszkodzenia oczu

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

15 articles · 5 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (15 articles)

1970: 1 articles19702015: 1 articles2018: 1 articles2019: 1 articles2020: 2 articles20202024: 3 articles2025: 1 articles2026: 2 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
4-tert-Butylbenzyl chloride · Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)- · p-tert-Butyl-alpha-chlorotoluene · p-(tert-Butyl)-alpha-chlorotoluene · EINECS 243-228-8 · Benzene, 1-chloromethyl-4-(1,1-dimethylethyl)- · RefChem:562385 · 243-228-8 · 19692-45-6 · 1-(tert-butyl)-4-(chloromethyl)benzene · p-tert-Butylbenzyl chloride · 1-tert-Butyl-4-(chloromethyl)benzene · 4-(tert-Butyl)benzyl chloride · MFCD00000918 · 1-(tert-Butyl)-4-(chloromethyl);benzene
Data sources
Related molecules
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📜 License & provenanceMolGod_License_1
Model
Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)- · 19692-45-6
InChIKey
WAXIFMGAKWIFDQ-UHFFFAOYSA-N
License
CC BY 4.0 International (source rights undetermined — not yet granted)
Attribution
MolGod Scientific — Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)- (CAS 19692-45-6)
License & provenance record
Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)- (CAS 19692-45-6) →
MolGod molecule record
Benzene, 1-(chloromethyl)-4-(1,1-dimethylethyl)- →
Source data
PubChem CID 88198 ↗
Model information
STL generated by MolGod · MolGod STL Exporter · generated 2026-09-25
SHA-256 (STL)
e0407d2f1f61e0f50c208965293514165b15c844d9360d4c504d443fc8237e3a
MD5 (STL)
1f9facc8ae04c89e41ea28c7c230cad6
Wikimedia Commons
not published yet
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