Structure

Ibuterol

CAS
53034-85-8
Catalog Number
ACM53034858
Category
Other Products
Molecular Weight
365.464 g/mol
Molecular Formula
C20H31NO5

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Specification

Synonyms
Ibuterol, Ibuterolum, Terbutalindiisobutyrat, Ibuterolum [INN-Latin], CID68698, KWD 2058, KWD-2058, EINECS 258-311-4, 5-(2-(tert-Butylamino)-1-hydroxyethyl)-m-phenylene diisobutyrate, 2-Methylpropanoicacid 5-(2-((1,1-dimethylethyl)amino)-1-hydroxy ethyl)-1,3-phenylene ester, 53034-85-8
IUPAC Name
[3-[2-(tert-butylamino)-1-hydroxyethyl]-5-(2-methylpropanoyloxy)phenyl] 2-methylpropanoate
Canonical SMILES
CC(C)C(=O)OC1=CC(=CC(=C1)C(CNC(C)(C)C)O)OC(=O)C(C)C
InChI Key
WKHOPHIMYDJVSA-UHFFFAOYSA-N
Boiling Point
478.4ºC at 760mmHg
Flash Point
243.2ºC
Density
1.083g/cm³
EC Number
258-311-4
Exact Mass
365.22000
H-Bond Acceptor
6
H-Bond Donor
2
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