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Technical details about Phenylephirine Oxazolidine, learn more about the structure, uses, toxicity, action, side effects and more

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2D Structure
1. Also known as: 114090-47-0, Dtxsid60765688
Molecular Formula
C14H21NO2
Molecular Weight
235.32  g/mol
InChI Key
RCAFBYLPBJRXII-UHFFFAOYSA-N

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-(2-tert-butyl-3-methyl-1,3-oxazolidin-5-yl)phenol
2.1.2 InChI
InChI=1S/C14H21NO2/c1-14(2,3)13-15(4)9-12(17-13)10-7-5-6-8-11(10)16/h5-8,12-13,16H,9H2,1-4H3
2.1.3 InChI Key
RCAFBYLPBJRXII-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)(C)C1N(CC(O1)C2=CC=CC=C2O)C
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 114090-47-0

2. Dtxsid60765688

2.3 Create Date
2013-05-21
3 Chemical and Physical Properties
Molecular Weight 235.32 g/mol
Molecular Formula C14H21NO2
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass235.157228913 g/mol
Monoisotopic Mass235.157228913 g/mol
Topological Polar Surface Area32.7 Ų
Heavy Atom Count17
Formal Charge0
Complexity261
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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