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Levopropranolol

HCID 91536
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
4199-09-1
Standard SMILES
CC(C)NC[C@H](O)COc1cccc2ccccc12
InChIKey
AQHHHDLHHXJYJD-AWEZNQCLSA-N
Molecular formula
C16H21NO2
Average molar mass
259.34 g/mol
Monoisotopic mass
259.15722891

Names & identifiers

Preferred name
Levopropranolol
IUPAC
(2S)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-ol
English name
(S)-1-(isopropylamino)-3-(naphthyloxy)propan-2-ol
Molecular formula
C16H21NO2
Molecular weight
259.34

Names & synonyms

4199-09-1(-)-propranololLevopropranololl-propranololPropranolol, L-s-(-)-propranolol74MLR03FLCEINECS 224-095-5(2S)-PROPRANOLOLPROPRANOLOL, (S)-S-(-)-1-ISOPROPYLAMINO-3-(1-NAPHTHOXY)-2-PROPANOL2-Propanol, 1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, (S)-
Show more names
(S)-1-(isopropylamino)-3-(naphthalen-1-yloxy)propan-2-ol(S)-1-Isopropylamino-3-(1-naphtyloxy)-2-propanol(2S)-1-Isopropylamino-3-(1-naphtyloxy)-2-propanol(2S)-1-(Isopropylamino)-3-(1-naphthyloxy)-2-propanol
2-PROPANOL, 1-((1-METHYLETHYL)AMINO)-3-(1-NAPHTHALENYLOXY)-, (2S)-2-PROPANOL, 1-((1-METHYLETHYL)AMINO)-3-(1-NAPHTHALENYLOXY)-, (S)-RefChem:799034(S)-propranolol1-(Isopropylamino)-3-(1-naphthyloxy)-2-propanol(S)-1-(Isopropylamino)-3-(naphthyloxy)propan-2-ol(2S)-1-naphthalen-1-yloxy-3-(propan-2-ylamino)propan-2-olCHEMBL452861

Database identifiers

CAS
4199-09-1
PubChem CID
91536
DTXSID
DTXSID90873366
ChEMBL
CHEMBL452861
UNII
74MLR03FLC
EC Number
224-095-5
Nikkaji
J224.993F

Properties

Computed structural properties

XLogP
3
Topological polar surface area
41.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
19
Formal charge
0
Complexity
257

Experimental & physicochemical properties

Dissociation Constants9.5

Physicochemical properties

FDA UNII
74 MLR03FLC · 74MLR03FLC

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Other Safety InformationIMAP assessments - 2-Propanol, 1-[(1-methylethyl)amino]-3-(1-naphthalenyloxy)-, (S)-: Environment tier I assessment

Chemistry & industry

Suppliers2 total

梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]

Related reactions

2 records
New reaction record
HRID 327076 reaction equation
HRID 327076As reactantuspto-grants-1993_12
HRID 981363 reaction equation
HRID 981363As productuspto-grants-1991_02

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes