5-(2-Amino-1-hydroxyethyl)-2-hydroxy-benzamideHydrochloride
Basic information
- CAS
32780-65-7- Standard SMILES
Cl.NCC(O)c1ccc(O)c(C(N)=O)c1- InChIKey
RVLDETSVEUQULS-UHFFFAOYSA-N- Molecular formula
- C9H13ClN2O3
- Average molar mass
- 232.66 g/mol
- Monoisotopic mass
- 232.06147
Names & identifiers
- Preferred name
- 5-(2-Amino-1-hydroxyethyl)-2-hydroxy-benzamideHydrochloride
- IUPAC
- 5-(2-amino-1-hydroxyethyl)-2-hydroxybenzamide;hydrochloride
- English name
- Labetalol EP impurity D
- Molecular formula
- C9H13ClN2O3
- Molecular weight
- 232.66
Names & synonyms
32780-65-75-(2-Amino-1-hydroxyethyl)-2-hydroxy-benzamideHydrochloride5-(2-AMINO-1-HYDROXYETHYL)-2-HYDROXYBENZAMIDE HYDROCHLORIDE5-(2-Amino-1-hydroxyethyl)-2-hydroxy-benzamide Hydrochloride5-(2-amino-1-hydroxyethyl)-2-hydroxybenzamide;hydrochlorideLabetalol EP Impurity D HClSCHEMBL9135207IL170150G829645-(2-amino-1-hydroxy-ethyl)-2-hydroxy-benzamide;hydrochlorideBENZAMIDE, 5-(2-AMINO-1-HYDROXYETHYL)-2-HYDROXY-, MONOHYDROCHLORIDELabetalol Impurity 12
Show more names
Labetalol EP impurity DLabetalol Impurity(Hydrochloride）Labetalol EP Impurity D HydrochlorideLabetalol Hydrochloride EP Impurity D5-(2-amino-1-hydroxyethyl)-2-hydroxybenzamideLabetalol Hydrochloride Impurity 4 (Labetalol Hydrochloride EP Impurity D)
Database identifiers
- CAS
32780-65-7- PubChem CID
- 15565664
Properties
Computed structural properties
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 210
Physicochemical properties
- Melting point
- 400 °C · >400 °C
- solubility
- DMSO (Slightly), Water (Slightly, Sonicated)
- form
- Solid
- color
- Pale Brown
Chemistry & industry
Applications
Uses5-(2-Amino-1-hydroxyethyl)-2-hydroxy-benzamide Hydrochloride is an impurity of Labetalol (L096495), a specific competitive antagonist at both a-and b-adrenergic receptor sites. Labetalol is used as an antihypertensive.
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Compound notes
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