Completing data — usually done within a minute
Basic information
- CAS
17107-33-4- Standard SMILES
COc1ccc2[nH]cc(CCN)c2c1.Cl- InChIKey
TXVAYRSEKRMEIF-UHFFFAOYSA-N- Molecular formula
- C11H15ClN2O
- Average molar mass
- 226.7 g/mol
- Monoisotopic mass
- 226.08729078
Names & identifiers
- Preferred name
- 1H-Indole-3-ethanamine, 5-methoxy-, hydrochloride (1:?)
- IUPAC
- 2-(5-methoxy-1H-indol-3-yl)ethanamine;hydrochloride
Names & synonyms
5-Methoxy-1H-indole-3-ethylamine hydrochloride17107-33-4RefChem:10582081H-Indole-3-ethanamine, 5-methoxy-, hydrochloride (1:?)241-177-65-Methoxytryptamine hydrochloride66-83-1O-Methylserotonin hydrochlorideMexamine hydrochloride5-Methoxy Tryptamine Hcl2-(5-methoxy-1H-indol-3-yl)ethanamine hydrochloride3-(2-Aminoethyl)-5-methoxyindole hydrochloride
Show more names
1H-Indole-3-ethanamine, 5-methoxy-, monohydrochloride5-Methoxytryptamine HCl4265IB6QEK5-Methoxytryptamine monohydrochlorideMexamine HCl2-(5-methoxyindol-3-yl)ethylamine, chlorideEINECS 200-637-62-(5-methoxy-1H-indol-3-yl)ethanamine;hydrochloride
Database identifiers
- CAS
17107-33-4、66-83-1- PubChem CID
- 6198
- DTXSID
DTXSID801017272- ChEMBL
CHEMBL1256138- UNII
- 4265IB6QEK
- EC Number
- 200-637-6、241-177-6
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 186
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 45 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
2 records
Compound notes
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