Ε-Caprolactam (CAS 105-60-2)

Ε-Caprolactam (CAS 105-60-2) is a chemical compound registered under number CAS 105-60-2, with the molecular formula C₆H₁₁NO, and a molar mass of 113.16 g/mol.

The molecule contains 19 atoms connected by 19 chemical bonds. The full systematic IUPAC name of this compound is azepan-2-one. 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 = -0.1 (negative value, a hydrophilic compound), polar surface area PSA = 29.1 Ų, 1 donors and 1 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.

Wzór sumaryczny	C6H11NO
Masa molowa	113.16 g/mol
IUPAC	azepan-2-one
SMILES	C1CCC(=O)NCC1
InChIKey	JBKVHLHDHHXQEQ-UHFFFAOYSA-N
logP (XLogP3)	-0.1
PSA	29.1 Ų
HBD / HBA	1 / 1
PubChem CID	CID 7768 ↗

Sygnał: Uwaga

H332 — Działa szkodliwie w następstwie wdychania

H302 — Działa szkodliwie po połknięciu

H335 — Może powodować podrażnienie dróg oddechowych

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

azepan-2-one · CAPROLACTAM · 105-60-2 · epsilon-Caprolactam · 2-Oxohexamethylenimine · 6-Caprolactam · Aminocaproic lactam · Hexahydro-2H-azepin-2-one · 6-Hexanelactam · 2-Oxohexamethyleneimine · 2-Azacycloheptanone · Hexanolactam · 2H-Azepin-2-one, hexahydro- · Hexahydro-2-azepinone · 2-Perhydroazepinone

• 📊 PubChem CID 7768 — NIH
• 🔬 NIST WebBook — spektroskopia
• 💊 ChEMBL — bioaktywność

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