Basic information
- CAS
51-29-6- Standard SMILES
CC(C)NCC(O)c1ccc(Cl)c(Cl)c1.Cl- InChIKey
IIEMWZNXXFGMCU-UHFFFAOYSA-N- Molecular formula
- C11H16Cl3NO
- Average molar mass
- 284.6 g/mol
- Monoisotopic mass
- 283.029747
Names & identifiers
- Preferred name
- Dichloroisoproterenol hydrochloride
- IUPAC
- 1-(3,4-dichlorophenyl)-2-(propan-2-ylamino)ethanol;hydrochloride
- English name
- DICHLOROISOPROTERENOL HYDROCHLORIDE
- Molecular formula
- C11H16Cl3NO
- Molecular weight
- 284.61
Names & synonyms
Dichloroisoproterenol hydrochloride51-29-6Compound 20522Lilly 205221-(3',4'-Dichlorophenyl)-2-isopropylaminoethanol hydrochlorideDichloroisoprenaline hydrochlorideDichlorisoproterenol hydrochlorideDichloroisoproterenol HClEINECS 200-088-2NSC 72104UNII-XD42620PS5AI3-52113
Show more names
Lilly-20522compound20522dcihydrochlorideDichloroisoproterenolHCldichloroisoprenalinehydrochloridedichlorisoproterenolhydrochlorideDICHLOROISOPROTERENOL HYDROCHLORIDECRYST ALLINE1-(3,4-DICHLOROPHENYL)-2-ISOPROPYLAMINOETHANOL HYDROCHLORIDE
XD42620PS5NSC-72104beta-Hydroxy-N-isopropyl-3,4-dichloro-phenethylamine hydrochlorideDTXSID401018909Benzenemethanol, 3,4-dichloro-alpha-(((1-methylethyl)amino)methyl)-, hydrochloride.beta.-Hydroxy-N-isopropyl-3,4-dichloro-phenethylamine hydrochlorideBENZYL ALCOHOL, 3,4-DICHLORO-alpha-((ISOPROPYLAMINO)METHYL)-, HYDROCHLORIDEBENZENEMETHANOL, 3,4-DICHLORO-.ALPHA.-(((1-METHYLETHYL)AMINO)METHYL)-, HYDROCHLORIDE (1:1)
Database identifiers
- CAS
51-29-6- PubChem CID
- 5805
- DTXSID
DTXSID401018909- UNII
- XD42620PS5
- EC Number
- 200-088-2
Properties
Computed structural properties
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 189
Physicochemical properties
- CAS DataBase Reference
- 51 · 51-29-6
- FDA UNII
- 42620 PS5 · XD42620PS5
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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