Basic information
- CAS
138-61-4- Standard SMILES
CC(N)C(O)c1ccc(O)c(O)c1.Cl- InChIKey
YRJLEOWRVNBAOI-UHFFFAOYSA-N- Molecular formula
- C9H14ClNO3
- Average molar mass
- 219.66 g/mol
- Monoisotopic mass
- 219.066221
Names & identifiers
- Preferred name
- 1,2-Benzenediol, 4-(2-amino-1-hydroxypropyl)-, hydrochloride (1:1)
- IUPAC
- 4-(2-amino-1-hydroxypropyl)benzene-1,2-diol;hydrochloride
Names & synonyms
138-61-41,2-Benzenediol, 4-(2-amino-1-hydroxypropyl)-, hydrochloride (1:1)RefChem:1052150Nordefrin hydrochloride4-(2-amino-1-hydroxypropyl)benzene-1,2-diol;hydrochlorideHomoarterenol hydrochlorideIsoadrenaline hydrochlorideNORDEFRIN HYDROCHLORIDENorhomoepinephrine hydrochlorideEINECS 205-336-3alpha-Methylnoradrenaline hydrochlorideAminopropanol pyrocatechol hydrochloride
Show more names
Homo arterenol hydrochloride3,4-Dihydroxynorephedrine hydrochloride(-)3,4-Dihydroxynorephedrine3,4-Dihydroxyphenylaminopropanol hydrochloride3,4-Dihydroxyphenylpropanolamine hydrochlorideDihydroxyphenylaminopropanolhydrochloridalpha-(1-Aminoethyl)-3,4-dihydroxybenzyl alcohol hydrochloride2-(3,4-Dihydroxyphenyl)-2-hydroxy-1-methylethylammonium chloride
Database identifiers
- CAS
138-61-4- PubChem CID
- 8744
- DTXSID
DTXSID80920974- ChEMBL
CHEMBL1612659- EC Number
- 205-336-3
Properties
Computed structural properties
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 165
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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