Structure

Ecastolol

CAS
77695-52-4
Catalog Number
ACM77695524
Category
Other Products
Molecular Weight
483.562
Molecular Formula
C26H33N3O6

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Specification

Synonyms
Ecastolol, Ecastolol [INN], UNII-EEB95DS30P, CID208905, 77695-52-4
IUPAC Name
N-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-2-hydroxypropoxy]-3-(1,2-oxazol-5-yl)phenyl]butanamide
Canonical SMILES
CCCC(=O)NC1=CC(=C(C=C1)OCC(CNCCC2=CC(=C(C=C2)OC)OC)O)C3=CC=NO3
InChI Key
CGUIWXDBHIFQJV-UHFFFAOYSA-N
Boiling Point
732.5ºC at 760 mmHg
Flash Point
396.8ºC
Density
1.202g/cm³
Exact Mass
483.23700
H-Bond Acceptor
8
H-Bond Donor
3
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