Methyl 3-aminocyclohexane-1-carboxylate hydrochloride
Grundinformationen
- CAS
712317-18-5- Standard-SMILES
COC(=O)C1CCCC(N)C1.Cl- InChIKey
OOFXENVWECZJBF-UHFFFAOYSA-N- Summenformel
- C8H16ClNO2
- Durchschnittliche Molmasse
- 193,67 g/mol
- Monoisotopische Masse
- 193,0869564
Namen und Bezeichner
- Bevorzugter Name
- Methyl 3-aminocyclohexane-1-carboxylate hydrochloride
- IUPAC
- methyl 3-aminocyclohexane-1-carboxylate;hydrochloride
- Englischer Name
- Methyl 3-aminocyclohexanecarboxylate hydrochloride
- Summenformel
- C8H16ClNO2
- Molmasse
- 193.67
Namen und Synonyme
methyl 3-aminocyclohexane-1-carboxylate hydrochlorideRefChem:815254838-115-0712317-18-5Methyl 3-aminocyclohexanecarboxylate hydrochlorideMFCD22392158methyl 3-aminocyclohexane-1-carboxylate;hydrochloridemethyl trans-3-aminocyclohexanecarboxylate hydrochloridetrans-Methyl-3-aminocyclohexanecarboxylatehydrochlorideMethyl3-aminocyclohexanecarboxylatehydrochlorideSCHEMBL2175329DTXSID50529014
Weitere Namen anzeigen
3-aminocyclohexanecarboxylic acidmethyl esterhydrochlorideCyclohexanecarboxylic acid, 3-amino-, methyl ester, hydrochloride (1:1)
OOFXENVWECZJBF-UHFFFAOYSA-NAKOS016006665SB22994SB22995SB22998SB45747BS-49568SY141706
Datenbank-Bezeichner
- CAS
712317-18-5- PubChem CID
- 13216967
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 52,3 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 147
Physikochemische Eigenschaften
- storage temp.
- 2 · 2-8°C, sealed storage, away from moisture
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (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 exposure; Respiratory 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.
Gefahrenhinweise
Hazard Classes and Categories
Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Skin Irrit. 2 (100%)；Eye Irrit. 2A (100%)；STOT SE 3 (100%)
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H315
Chemie und Industrie
Anwendungen
VerwendenMethyl 3-Aminocyclohexane-1-carboxylate is an intermediate used to prepare isophthalates as cardiovascular agents.
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Compound Net Biotechnology Inc.15266686121 · [email protected]
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