Basic information
- CAS
63937-92-8- Standard SMILES
C[NH+]1CCc2cc(O)c(O)cc2C1.[Cl-]- InChIKey
URMJNZMQXGBIFX-UHFFFAOYSA-N- Molecular formula
- C10H14ClNO2
- Average molar mass
- 215.67 g/mol
- Monoisotopic mass
- 215.0713064
Names & identifiers
- Preferred name
- 2-Methyl-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochloride
- IUPAC
- 2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol chloride
Names & synonyms
RefChem:474731633-200-72-Methyl-1,2,3,4-tetrahydro-6,7-isoquinolinediol hydrochlorideN-Methyl-6,7-dihydroxy-1,2,3,4-tetrahydroisoquinoline hydrochloride2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-6,7-diol;chlorideDTXSID4013517116,7-Dihydroxy-2-methyl-1,2,3,4-tetrahydroisoquinoline hydrochlorideIsoquinoline, N-methyl-6,7-dihydroxy-1,2,3,4-tetrahydro-, hydrochlorideISOQUINOLINE-6,7-DIOL, 1,2,3,4-TETRAHYDRO-2-METHYL-, HYDROCHLORIDENS00126273
Database identifiers
- CAS
63937-92-8- PubChem CID
- 45540
- DTXSID
DTXSID401351711- EC Number
- 633-200-7
Properties
Computed structural properties
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- 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)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
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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