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5- (4-Morpholinyl) -2-nitrophenol

CAT: 0024-sc-267889Size: 1 gDry Ice: NoHazardous: No
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CAT#:0024-sc-267889Size:1 g
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CAS Number
175135-19-0

Chemical Information

5-Morpholino-2-nitrophenol
CAS Number175135-19-0
PubChem CID2799399
IUPAC Name5-morpholin-4-yl-2-nitrophenol
Molecular FormulaC10H12N2O4
Molecular Weight224.21
XLogP1.6
Topological Polar Surface Area78.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count16
Formal Charge0
Complexity250
SMILES
C1COCCN1C2=CC(=C(C=C2)[N+](=O)[O-])O
InChI
InChI=1S/C10H12N2O4/c13-10-7-8(1-2-9(10)12(14)15)11-3-5-16-6-4-11/h1-2,7,13H,3-6H2
InChIKey
XXIIDARBNMZFEH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Morpholino-2-nitrophenol
CAS: 175135-19-0
CID: 2799399
Formula: C10H12N2O4
MW: 224.21
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight224.21
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass224.07970687
Monoisotopic Mass224.07970687
Topological Polar Surface Area78.5 Ų
Heavy Atom Count16
Formal Charge0
Complexity250
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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