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Chemical structure of Albuterol methyl ether

GC42764

Albuterol methyl ether

Also known as 4-[2-(tert-butylamino)-1-methoxyethyl]-2-(hydroxymethyl)phenol

Salbutamol (albuterol) is a selective β2-adrenergic partial agonist that is used as a bronchodilator

ChemicalCAS870076-72-5MW253.3FormulaC14H23NO3
CAS number
870076-72-5
Molecular weight
253.3
Formula
C14H23NO3
Solubility
DMF: 10 mg/ml,DMSO: 5 mg/ml,Ethanol: 10 mg/ml,PBS (pH 7·2): 5 mg/ml
InChIKey
UMHASVFLCHGDPW-UHFFFAOYSA-N
Catalogue number
GC42764
Brand
GLPBIO
Computed properties PubChem CID 11514362 · XLogP 0.8 · TPSA 61.7 Ų · H-bond donors 3
XLogP
0.8
TPSA
61.7 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
18

SMILES CC(C)(C)NCC(C1=CC(=C(C=C1)O)CO)OC

Computed descriptors from PubChem (CID 11514362), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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