Basic information
- Standard SMILES
Cl.NCCc1c[nH]c2ccccc12- InChIKey
KDFBGNBTTMPNIG-UHFFFAOYSA-N- Molecular formula
- C10H13ClN2
- Average molar mass
- 196.67 g/mol
- Monoisotopic mass
- 196.0767261
Names & identifiers
- Preferred name
- Tryptamine hydrochloride
- IUPAC
- 2-(1H-indol-3-yl)ethanamine;hydrochloride
Names & synonyms
Show more names
Database identifiers
- CAS
343-94-2- PubChem CID
- 67652
- DTXSID
DTXSID9059836- ChEMBL
CHEMBL1255796- UNII
- 2942LD1Q06
- EC Number
- 206-446-4
Properties
Computed structural properties
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 147
Safety & regulation
GHS classification
GHS Classification
Danger
H301 (97%): Toxic if swallowed [Danger Acute toxicity, oral];H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 33 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory information
Chemistry & industry
Uses & manufacturing
Related reactions
Linked notes
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