1-Isothiocyanato-2-methylcyclohexane

https://huagongshe.com/de/chemical/3831004

Identifikatoren & physikalische Daten

CAS No.	885460-75-3
Summenformel	C8H13NS
Durchschnittliche Molmasse	155,26 g/mol
Monoisotopische Masse	155,07687059 g/mol
SMILES	CC1CCCCC1N=C=S
InChIKey	PZMGXEOAUNVRIR-UHFFFAOYSA-N
PubChem CID	3831004
EC No.	102-645-4

Chemische & physikalische Eigenschaften

XLogP	3,8
Polarare Oberfläche (TPSA)	44,5
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	2
Frei drehbare Bindungen	1
Schwere Atome	10
Formalladung	0
Komplexität	149

Sicherheit & Vorschriften

GHS-Einstufung	DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P233, P260, P261, P264, P270, P271, P272, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P333+P317, P342+P316, P362+P364, P363, P403, 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	Acute Tox. 4 (100%)

GHS-Einstufung

DangerH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P233, P260, P261, P264, P270, P271, P272, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P333+P317, P342+P316, P362+P364, P363, P403, 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

Acute Tox. 4 (100%)