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Bisoprolol EP Impurity T

CAT: 1299-RM-B191620-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-B191620-01Size:10 mg
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CAS Number
1173203-26-3
Synonyms
4- ((3-isopropyl-2-oxooxazolidin-5-yl) methoxy) benzaldehyde
Molecular Formula
C14H17NO4
Molecular Weight
263.29
Target Alternative Name
Bisoprolol
Product Name Synonym
4- ((3-isopropyl-2-oxooxazolidin-5-yl) methoxy) benzaldehyde

Chemical Information

4-((3-(1-Methylethyl)-2-oxo-5-oxazolidinyl)methoxy)benzaldehyde
CAS Number1173203-26-3
PubChem CID46218912
IUPAC Name4-[(2-oxo-3-propan-2-yl-1,3-oxazolidin-5-yl)methoxy]benzaldehyde
Molecular FormulaC14H17NO4
Molecular Weight263.29
XLogP1.9
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count19
Formal Charge0
Complexity323
SMILES
CC(C)N1CC(OC1=O)COC2=CC=C(C=C2)C=O
InChI
InChI=1S/C14H17NO4/c1-10(2)15-7-13(19-14(15)17)9-18-12-5-3-11(8-16)4-6-12/h3-6,8,10,13H,7,9H2,1-2H3
InChIKey
BNPFYOSKJDWANL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-((3-(1-Methylethyl)-2-oxo-5-oxazolidinyl)methoxy)benzaldehyde
CAS: 1173203-26-3
CID: 46218912
Formula: C14H17NO4
MW: 263.29
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight263.29
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass263.11575802
Monoisotopic Mass263.11575802
Topological Polar Surface Area55.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity323
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes