- InChI
- InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)
- InChI Key
- METKIMKYRPQLGS-UHFFFAOYSA-N
- Formula
- C14H22N2O3
- SMILES
- CC(C)NCC(O)COc1ccc(CC(N)=O)cc1
- Molecular Weight1
- 266.34
- CAS
- 29122-68-7
- Other Names
-
- (+) 4-[2'-Hydroxy-3'-(isopropylamino)propoxy]-phenylacetamide (atenolol)
- 1-p-Carbamoylmethylphenoxy-3-isopropylamino-2-propanol
- 2-(4-[2-Hydroxy-3-(isopropylamino)propoxy]phenyl)acetamide
- 2-(p-(2-Hydroxy-3-(isopropylamino)propoxy)phenyl)acetamide
- 4-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzeneacetamide
- Acetamide, 2-(p-(2-hydroxy-3-(isopropylamino)propoxy)phenyl)-
- Alinor
- Altol
- Anselol
- Antipressan
- Apo-Atenolol
- Atcardil
- Atecard
- Atehexal
- Atenblock
- Atendol
- Atenet
- Ateni
- Atenil
- Atenol
- Atereal
- Aterol
- Benzeneacetamide, 4-[2-hydroxy-3-[(1-methylethyl)amino]propoxy]-
- Betablok
- Betacard
- Blokium
- Corotenol
- Cuxanorm
- Duraatenolol
- Evitocor
- Farnormin
- Felo-Bits
- Hipres
- Hypoten
- ICI 66082
- Ibinolo
- Internolol
- Lo-ten
- Lotenal
- Myocord
- Normalol
- Normiten
- Noten
- Oraday
- Premorine
- Prenolol
- Prenormine
- Seles beta
- Selobloc
- Serten
- Stermin
- Tenidon
- Teno-basan
- Tenoblock
- Tenolol
- Tenoprin
- Tenormin
- Tenormine
- Tensimin
- Tredol
- Uniloc
- Vascoten
- Vericordin
- Wesipin
- Xaten
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -50.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -427.56 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.79 | kJ/mol | Joback Calculated Property |
| ΔsubH° | 140.00 ± 3.70 | kJ/mol | NIST |
| ΔvapH° | 91.83 | kJ/mol | Joback Calculated Property |
| log10WS | 0.04 | Aq. Sol... | |
| logPoct/wat | 0.452 | Crippen Calculated Property | |
| McVol | 217.630 | ml/mol | McGowan Calculated Property |
| Pc | 2445.89 | kPa | Joback Calculated Property |
| Tboil | 841.67 | K | Joback Calculated Property |
| Tc | 1049.15 | K | Joback Calculated Property |
| Tfus | 419.75 | K | Aq. Sol... |
| Vc | 0.806 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [671.19; 731.83] | J/mol×K | [841.67; 1049.15] | 
|
| Cp,gas | 671.19 | J/mol×K | 841.67 | Joback Calculated Property |
| Cp,gas | 683.46 | J/mol×K | 876.25 | Joback Calculated Property |
| Cp,gas | 694.83 | J/mol×K | 910.83 | Joback Calculated Property |
| Cp,gas | 705.32 | J/mol×K | 945.41 | Joback Calculated Property |
| Cp,gas | 714.96 | J/mol×K | 979.99 | Joback Calculated Property |
| Cp,gas | 723.79 | J/mol×K | 1014.57 | Joback Calculated Property |
| Cp,gas | 731.83 | J/mol×K | 1049.15 | Joback Calculated Property |
| ΔfusH | [35.66; 38.70] | kJ/mol | [423.40; 426.10] |
|
| ΔfusH | 35.66 | kJ/mol | 423.40 | NIST |
| ΔfusH | 38.70 | kJ/mol | 426.10 | NIST |
Similar Compounds
Find more compounds similar to Atenolol.
Sources
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