Basic information
- CAS
1432680-42-6- Standard SMILES
CC1NCCc2cc(Cl)c(Cl)cc21.Cl- InChIKey
YBEGXUPRXFFQFK-UHFFFAOYSA-N- Molecular formula
- C10H12Cl3N
- Average molar mass
- 252.6 g/mol
- Monoisotopic mass
- 251.003532
Names & identifiers
- Preferred name
- 6,7-Dichloro-1-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride
- IUPAC
- 6,7-dichloro-1-methyl-1,2,3,4-tetrahydroisoquinoline;hydrochloride
Names & synonyms
6,7-dichloro-1-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride1432680-42-6RefChem:538613968-278-46,7-dichloro-1-methyl-1,2,3,4-tetrahydroisoquinoline;hydrochlorideHHC68042CS-0225986EN300-1254156,7-dichloro-1-methyl-1,2,3,4-tetrahydroisoquinolinehydrochloride
Database identifiers
- CAS
1432680-42-6- PubChem CID
- 71758043
- EC Number
- 968-278-4
Properties
Computed structural properties
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 186
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/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.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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