Mescaline hydrochloride
Basic information
- CAS
832-92-8- Standard SMILES
COc1cc(CCN)cc(OC)c1OC.Cl- InChIKey
FVZVSNDNKMOYKF-UHFFFAOYSA-N- Molecular formula
- C11H18ClNO3
- Average molar mass
- 247.72 g/mol
- Monoisotopic mass
- 247.0975211
Overview
See also: Mescaline (annotation moved to).
Names & identifiers
- Preferred name
- Mescaline hydrochloride
- IUPAC
- 2-(3,4,5-trimethoxyphenyl)ethanamine;hydrochloride
Names & synonyms
Mescaline hydrochloride832-92-8Mescaline hydrochloride saltmescaline HClBenzeneethanamine, 3,4,5-trimethoxy-, hydrochlorideDTXSID70488793,4,5-Trimethoxyphenethylamine hydrochlorideEINECS 212-626-3XQG91WTZ12NSC 172790Phenethylamine, 3,4,5-trimethoxy-, hydrochlorideNSC-172790
Show more names
3,4,5-Trimethoxy-beta-phenylethylamine hydrochlorideDTXCID70288053,4,5-Trimethoxybenzeneethanamine HydrochlorideRefChem:811138Benzeneethanamine, 3,4,5-trimethoxy-, hydrochloride (9CI)212-626-3Mescaline.HCl2-(3,4,5-trimethoxyphenyl)ethan-1-amine hydrochloride
Database identifiers
- CAS
832-92-8- PubChem CID
- 71580
- DTXSID
DTXSID7048879- ChEMBL
CHEMBL534907- UNII
- XQG91WTZ12
- EC Number
- 212-626-3
Properties
Computed structural properties
- Topological polar surface area
- 53.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 163
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
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 41 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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