3,4-Dihydro-2-(((p-hydroxyphenethyl)amino)methyl)-1(2H)-naphthalenone hydrochloride
Basic information
- CAS
30007-39-7- Standard SMILES
O=C1c2ccccc2CCC1C[NH2+]CCc1ccc(O)cc1.[Cl-]- InChIKey
VCZXZECZIRGUCZ-UHFFFAOYSA-N- Molecular formula
- C19H22ClNO2
- Average molar mass
- 331.8 g/mol
- Monoisotopic mass
- 331.1339066
Overview
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Names & identifiers
- Preferred name
- 3,4-Dihydro-2-(((p-hydroxyphenethyl)amino)methyl)-1(2H)-naphthalenone hydrochloride
- IUPAC
- 2-(4-hydroxyphenyl)ethyl-[(1-oxo-3,4-dihydro-2H-naphthalen-2-yl)methyl]azanium chloride
- English name
- Heat hydrochloride
- Molecular formula
- C19H21NO2.ClH
- Molecular weight
- 331.84
Names & synonyms
3,4-Dihydro-2-(((p-hydroxyphenethyl)amino)methyl)-1(2H)-naphthalenone hydrochlorideHEAT2-(4-hydroxyphenyl)ethyl-[(1-oxo-3,4-dihydro-2H-naphthalen-2-yl)methyl]azanium;chlorideBE-2254 hydrochloride2-(beta-(Hydroxyphenyl)ethylaminomethyl)tetralone hydrochloride3,4-Dihydro-2-(((2-(4-hydroxyphenyl)ethyl)amino)methyl)-1(2H)-naphthalenone hydrochloride2-[[2-(4-hydroxyphenyl)ethylamino]methyl]-3,4-dihydro-2H-naphthalen-1-one;hydrochlorideHEATHClHeat hydrochlorideHETA Hydrichloridebe-2254hydrochlorideHEAT hydrochloride (BE2254)
Show more names
3,4-Dihydro-2-(((2-p-hydroxypHEAT hydrochloride (BE2254), alpha1 adrenoceptor antagonist2-(beta-(hydroxyphenyl)ethylaminomethyl)tetralonehydrochloride2-{[β-(4-Hydroxyphenyl)ethyl]aminomethyl}-1-tetralonehydrochloride
Properties
Computed structural properties
- Topological polar surface area
- 53.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 362
Physicochemical properties
- storage temp.
- -20 °C · Desiccate at -20°C
- solubility
- 100 mM · Soluble to 100 mM in DMSO
- form
- Powder
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Applications
UsesHEAT Hydrochloride is an adrenergic antagonist of central noradrenergic receptor stimulation. Affects the sympathetic nervous system.
Related reactions
0 records
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Compound notes
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