Molecular properties
- Formula
- C18H31NO4
- Molar mass
- 325.45 g·mol−1
- Exact mass
- 325.2253 Da
- 4
- PubChem CID
- 2405
Molecule record
1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]propan-2-ol
C18H31NO4
325.45 g/mol
Loading structure
Functional groups
Alcohol
Alkane / alkyl carbon
Aromatic ring
Ether
Secondary amine
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- (+-)-1-((alpha-(2-Isopropoxyethoxy)-p-tolyl)oxy)-3-(isopropylamino)-2-propanol
- (+/-)-Bisoprolol (hemifumarate)
- (RS)-1-(4-(2-Isopropoxyethoxymethyl)phenoxy)-3-(isopropylamino)-2-propanol
- 2-Propanol, 1-(4-((2-(1-methylethoxy)ethoxy)methyl)phenoxy)-3-((1-methylethyl)amino)-, (+-)-
- 66722-44-9
- BISOPROLOL
- Bisocor
- Bisoprolol fumerate
Show all 24 synonyms
- Bisoprololum
- Bisoprololum [Latin]
- C07AB07
- CHEBI:3127
- CL 297939
- CL297939
- Cardensiel
- DTXCID602682
- DTXSID6022682
- EMD 33 512
- Hydrochloride, Bisoprolol
- MFCD00865795
- RefChem:5608
- Y41JS2NL6U
- [2-hydroxy-3-(4-{[2-(propan-2-yloxy)ethoxy]methyl}phenoxy)propyl](propan-2-yl)amine
- bisoprololo
Structure identifiers
- Canonical SMILES
- CC(C)NCC(O)COc1ccc(COCCOC(C)C)cc1
- Isomeric SMILES
- CC(C)NCC(COC1=CC=C(C=C1)COCCOC(C)C)O
- InChI
- InChI=1S/C18H31NO4/c1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4/h5-8,14-15,17,19-20H,9-13H2,1-4H3
- InChIKey
- VHYCDWMUTMEGQY-UHFFFAOYSA-N
- PubChem CID
- 2405
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]propan-2-ol; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1-(propan-2-ylamino)-3-[4-(2-propan-2-yloxyethoxymethyl)phenoxy]propan-2-ol; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.