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3- (3-Fluorophenoxy) propanamide

CAT: 0926-UTB73420-02Size: 2.5 gDry Ice: NoHazardous: No
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CAT#:0926-UTB73420-02Size:2.5 g
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CAS Number
1094734-20-9
MDL Number
MFCD11644015
Smiles
C1=CC (=CC (=C1) F) OCCC (=O) N
Molecular Formula
C9H10FNO2
Molecular Weight
183.18 g/mol
Controlled
No

Chemical Information

3-(3-Fluorophenoxy)propanamide
CAS Number1094734-20-9
PubChem CID43132205
IUPAC Name3-(3-fluorophenoxy)propanamide
Molecular FormulaC9H10FNO2
Molecular Weight183.18
XLogP0.9
Topological Polar Surface Area52.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count13
Formal Charge0
Complexity175
SMILES
C1=CC(=CC(=C1)F)OCCC(=O)N
InChI
InChI=1S/C9H10FNO2/c10-7-2-1-3-8(6-7)13-5-4-9(11)12/h1-3,6H,4-5H2,(H2,11,12)
InChIKey
ZYTPYBGUTQWYEI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(3-Fluorophenoxy)propanamide
CAS: 1094734-20-9
CID: 43132205
Formula: C9H10FNO2
MW: 183.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight183.18
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass183.06955672
Monoisotopic Mass183.06955672
Topological Polar Surface Area52.3 Ų
Heavy Atom Count13
Formal Charge0
Complexity175
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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Alternative Products

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sc-3102953- (Isopropylamino) propanamide
TRC-M493115-250MG3-(Methylpentylamino)-propanamide
sc-3102043- (Cyclohexylamino) propanamide
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