2H-1-Benzopyran-6-methanamine, 3,4-dihydro-alpha-phenyl-, hydrochloride
Basic information
- CAS
108132-34-9- Standard SMILES
C[NH+](c1ccccc1)c1ccc2c(c1)CCCO2.[Cl-]- InChIKey
LDRFORWKFVHZIR-UHFFFAOYSA-N- Molecular formula
- C16H18ClNO
- Average molar mass
- 275.77 g/mol
- Monoisotopic mass
- 275.1076919
Names & identifiers
- Preferred name
- 2H-1-Benzopyran-6-methanamine, 3,4-dihydro-alpha-phenyl-, hydrochloride
- IUPAC
- 3,4-dihydro-2H-chromen-6-yl-methyl-phenylazanium chloride
Names & synonyms
2H-1-BENZOPYRAN-6-METHANAMINE, 3,4-DIHYDRO-alpha-PHENYL-, HYDROCHLORIDERefChem:1065199108132-34-92H-1-Benzopyran-6-methylamine, 3,4-dihydro-alpha-phenyl-, hydrochloride3,4-Dihydro-alpha-phenyl-2H-1-benzopyran-6-methanamine hydrochloride
Database identifiers
- CAS
108132-34-9- PubChem CID
- 60217
- EC Number
- 186-768-9
Properties
Computed structural properties
- Topological polar surface area
- 13.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 262
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]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, 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 CategoriesAcute Tox. 4 (100%)
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Related reactions
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Compound notes
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