Acebutolol
Properties
- Molecular formula
- C18H28N2O4
- Molar mass
- 336.43 g/mol
- Exact mass
- 336.2049 Da
- Melting point
- 119–123 °C
- pKa
- 9.52
- logP
- 3.02Crippen estimate
- Polar surface area
- 91.2 Ų
- H-bond donors / acceptors
- 3 / 5
- Rotatable bonds
- 10
Hazards
- H362 May cause harm to breast-fed children100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P260, P263, P264, P270, P318
Identifiers
CAS number
37517-30-9SMILES
CCCC(O)=Nc1ccc(OCC(O)CNC(C)C)c(C(C)=O)c1InChIKey
GOEMGAFJFRBGGG-UHFFFAOYSA-NInChI
InChI=1S/C18H28N2O4/c1-5-6-18(23)20-14-7-8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20,23)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
10 names
- Butanamide, N-[3-acetyl-4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]-
- Butanamide, N-[3-acetyl-4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]-, (±)-
- N-[3-Acetyl-4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]phenyl]butanamide
- (±)-Acebutolol
- Dl-Acebutolol
- Neptal
- Prent
- Monitan
- (RS)-Acebutolol
- Acecor
Work with Acebutolol
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Celiprolol56980-93-955 % similar
2-Acetyl-4-butyramidophenol40188-45-254 % similar
Celiprolol hydrochloride57470-78-753 % similar
Propranolol525-66-641 % similar
Metoprolol succinate98418-47-439 % similar
Esmolol81147-92-439 % similar
(+)-Propranolol hydrochloride13071-11-939 % similar
Propranolol hydrochloride318-98-939 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds