- Bambuterol
- Bambuterol hydrochloride
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Cas Database |
| Name |
Bambuterol hydrochloride |
EINECS | 643-060-9 |
| CAS No. | 81732-46-9 | Density | 1.154g/cm3 |
| PSA | 91.34000 | LogP | 3.42180 |
| Solubility | soluble in water | Melting Point |
222-224 °C |
| Formula | C18H30ClN3O5 | Boiling Point | 500.9 °C at 760 mmHg |
| Molecular Weight | 403.906 | Flash Point | 256.7 °C |
| Transport Information | N/A | Appearance | white solid |
| Safety | 24/25 | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Carbamicacid, dimethyl-, 5-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]-1,3-phenyleneester, monohydrochloride (9CI);Bambec;KWD 2183;Carbamic acid,N,N-dimethyl-,3-[[(dimethylamino)carbonyl]oxy]-5-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]phenylester, hydrochloride (1:1); |
Article Data | 3 |
Bambuterol hydrochloride Chemical Properties
Structure of Bambuterol hydrochloride (CAS NO.81732-46-9):
IUPAC Name: [3-[2-(tert-Butylamino)-1-hydroxyethyl]-5-(dimethylcarbamoyloxy)phenyl]N,N-dimethylcarbamate hydrochloride
Molecular Weight: 403.9009 g/mol
Molecular Formula: C18H30ClN3O5
Flash Point: 256.7 °C
Enthalpy of Vaporization: 81.04 kJ/mol
Boiling Point: 500.9 °C at 760 mmHg
Vapour Pressure: 7.49E-11 mmHg at 25 °C
H-Bond Donor: 3
H-Bond Acceptor: 6
Rotatable Bond Count: 8
Exact Mass: 403.187399
MonoIsotopic Mass: 403.187399
Topological Polar Surface Area: 91.3
Heavy Atom Count: 27
Canonical SMILES: CC(C)(C)NCC(C1=CC(=CC(=C1)OC(=O)N(C)C)OC(=O)N(C)C)O.Cl
InChI: InChI=1S/C18H29N3O5.ClH/c1-18(2,3)19-11-15(22)12-8-13(25-16(23)20(4)5)10-14(9-12)26-17(24)21(6)7;/h8-10,15,19,22H,11H2,1-7H3;1H
InChIKey: LBARATORRVNNQM-UHFFFAOYSA-N
Product Categories: Active Pharmaceutical Ingredients; Intermediates & Fine Chemicals; Pharmaceuticals; Bambuterol
Bambuterol hydrochloride Uses
Bambuterol hydrochloride (CAS NO.81732-46-9) can be used for active pharmaceutical ingredients and could produce ester prodrug of the -adrenergic agonist terbutaline.
Bambuterol hydrochloride Safety Profile
WGK Germany: 3
Bambuterol hydrochloride Specification
Bambuterol hydrochloride (CAS NO.81732-46-9) is also named as Carbamic acid, dimethyl-, 5-(2-((1,1-dimethylethyl)amino)-1-hydroxyethyl)-1,3-phenylene ester, monohydrochloride ; Carbamic acid,N,N-dimethyl-,3-[[(dimethylamino)carbonyl]oxy]-5-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]phenylester, hydrochloride (1:1) . Bambuterol hydrochloride (CAS NO.81732-46-9) is white solid.
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