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10-phenylacridin-9-one

CAT: 1731-FH 10 0S59-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:1731-FH 10 0S59-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
5472-23-1
MDL Number
MFCD01463673
Purity
0.95
Smiles
O=c1c2ccccc2n (-c2ccccc2) c2ccccc12
Shipping Conditions
Room temperature, no cold chain required

Chemical Information

10-Phenyl-9(10H)-acridone
CAS Number5472-23-1
PubChem CID138522
IUPAC Name10-phenylacridin-9-one
Molecular FormulaC19H13NO
Molecular Weight271.3
XLogP4.7
Topological Polar Surface Area20.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count21
Formal Charge0
Complexity361
SMILES
C1=CC=C(C=C1)N2C3=CC=CC=C3C(=O)C4=CC=CC=C42
InChI
InChI=1S/C19H13NO/c21-19-15-10-4-6-12-17(15)20(14-8-2-1-3-9-14)18-13-7-5-11-16(18)19/h1-13H
InChIKey
GOKIEMZASYETFM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 10-Phenyl-9(10H)-acridone
CAS: 5472-23-1
CID: 138522
Formula: C19H13NO
MW: 271.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight271.3
XLogP34.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass271.099714038
Monoisotopic Mass271.099714038
Topological Polar Surface Area20.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity361
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