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30392-40-6 | Benzoic acid, 4-methyl-, 1,1'-[4-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]-1,2-phenylene] ester
CAS No: 30392-40-6 Catalog No: AG002ZZH MDL No:
Product Description
Catalog Number:
AG002ZZH
Chemical Name:
Benzoic acid, 4-methyl-, 1,1'-[4-[2-[(1,1-dimethylethyl)amino]-1-hydroxyethyl]-1,2-phenylene] ester
CAS Number:
30392-40-6
IUPAC Name:
[4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(4-methylbenzoyl)oxyphenyl] 4-methylbenzoate
InChI:
InChI=1S/C28H31NO5/c1-18-6-10-20(11-7-18)26(31)33-24-15-14-22(23(30)17-29-28(3,4)5)16-25(24)34-27(32)21-12-8-19(2)9-13-21/h6-16,23,29-30H,17H2,1-5H3
InChI Key:
FZGVEKPRDOIXJY-UHFFFAOYSA-N
Properties
Complexity:
658
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
461.22g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
461.558g/mol
Monoisotopic Mass:
461.22g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
Literature
| Title | Journal |
|---|---|
| Accuracy of Veterans Affairs databases for diagnoses of chronic diseases. | Preventing chronic disease 20091001 |
| Efficacy and safety of inhaled bitolterol mesylate via metered-dose inhaler in children with asthma. | Annals of allergy, asthma & immunology : official publication of the American College of Allergy, Asthma, & Immunology 19960101 |
| Retrospective study of bitolterol mesylate in the treatment of conditions associated with reversible bronchospasm. | Advances in therapy 19950101 |
| Multicenter dose-ranging study of bitolterol mesylate solution for nebulization in children with asthma. | Annals of allergy 19940301 |
| Bitolterol. A preliminary review of its pharmacological properties and therapeutic efficacy in reversible obstructive airways disease. | Drugs 19880101 |
| Bitolterol and albuterol metered-dose aerosols: comparison of two long-acting beta 2-adrenergic bronchodilators for treatment of asthma. | The Journal of allergy and clinical immunology 19850101 |
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