4-(3-Amino-2-hydroxypropoxy)phenylacetamide
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4-(3-Amino-2-hydroxypropoxy)phenylacetamide
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CAS No:
81346-71-6
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Formula:
C11H16N2O3
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Chemical Name:
4-(3-Amino-2-hydroxypropoxy)phenylacetamide
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Synonyms:
atenolol-desisopropyl;4-(3-AMINO-2-HYDROXYPROPOXY)PHENYLACETAMIDE;2-[4-(3-amino-2-hydroxypropoxy)phenyl]acetamide;2-(4-(3-amino-2-hydroxypropoxy)phenyl)acetamide;Deisopropylatenolol;Atenolol impurity J;Dis(isopropyl) atenolol;Atenolol impurity J [EP];CHEBI:83530;CTK5E8723
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CAS No:
Description
White Solid
Atenolol-desisopropyl is a member of the class of ethanolamines that is 2-aminoethanol substituted by a [4-(2-amino-2-oxoethyl)phenoxy]methyl group at position 1. It is a metabolite of the drug atenolol. It has a role as a marine xenobiotic metabolite and a drug metabolite. It is an aromatic ether, a member of ethanolamines, a propanolamine, a monocarboxylic acid amide and a primary amino compound.
Safety Information
22
Xn
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P264, P270, P301+P310, P321, P330, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
4-(3-Amino-2-hydroxypropoxy)phenylacetamide Use and Manufacturing
Pharmaceuticals -> Cardiovascular system -> Beta blockers -> Beta blocking agents, selective -> Transformation products
Computed Properties
Molecular Weight:224.26
XLogP3:-1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:224.11609238
Monoisotopic Mass:224.11609238
Topological Polar Surface Area:98.6
Heavy Atom Count:16
Complexity:215
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
4-(3-Amino-2-hydroxypropoxy)phenylacetamide
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