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O-Flutamide

CAT: 1596-AR-F01849-02Size: 25 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-F01849-02Size:25 Units
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CAS Number
151262-93-0
Synonyms
N- (2-nitro-5- (trifluoromethyl) phenyl) isobutyramide; o-Flutamide
Molecular Formula
C11H11F3N2O3
Molecular Weight
276.22
API Name
Flutamide

Chemical Information

O-Flutamide
CAS Number151262-93-0
PubChem CID384646
IUPAC Name2-methyl-N-[2-nitro-5-(trifluoromethyl)phenyl]propanamide
Molecular FormulaC11H11F3N2O3
Molecular Weight276.21
XLogP3.7
Topological Polar Surface Area74.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity352
SMILES
CC(C)C(=O)NC1=C(C=CC(=C1)C(F)(F)F)[N+](=O)[O-]
InChI
InChI=1S/C11H11F3N2O3/c1-6(2)10(17)15-8-5-7(11(12,13)14)3-4-9(8)16(18)19/h3-6H,1-2H3,(H,15,17)
InChIKey
ZMFQELZYFBRXFJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of O-Flutamide
CAS: 151262-93-0
CID: 384646
Formula: C11H11F3N2O3
MW: 276.21
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight276.21
XLogP33.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass276.07217670
Monoisotopic Mass276.07217670
Topological Polar Surface Area74.9 Ų
Heavy Atom Count19
Formal Charge0
Complexity352
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