4-[(Cyclohexylcarbamoyl)amino]butanoic acid

https://huagongshe.com/de/chemical/6420119

Identifikatoren & physikalische Daten

CAS No.	511552-46-8
Summenformel	C11H20N2O3
Durchschnittliche Molmasse	228,29 g/mol
Monoisotopische Masse	228,1473925 g/mol
SMILES	O=C(O)CCCNC(=O)NC1CCCCC1
InChIKey	WSVFRGGLURJIMG-UHFFFAOYSA-N
PubChem CID	6420119
ChEMBL	CHEMBL219695
EC No.	107-680-9

Chemische & physikalische Eigenschaften

XLogP	1
Polarare Oberfläche (TPSA)	78,4
H-Brücken-Donoren	3
H-Brücken-Akzeptoren	3
Frei drehbare Bindungen	5
Schwere Atome	16
Formalladung	0
Komplexität	237

Sicherheit & Vorschriften

GHS-Einstufung	WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and Categories	Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%)

GHS-Einstufung

WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposureRespiratory tract irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard Classes and Categories

Skin Irrit. 2 (100%)Eye Irrit. 2A (100%)STOT SE 3 (100%)