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3- (Difluoromethoxy) piperidine

CAT: 0926-QZB52891-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-QZB52891-01Size:50 mg
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CAS Number
1240528-91-9
MDL Number
MFCD24843076
Smiles
C1CC (CNC1) OC (F) F
Molecular Formula
C6H11F2NO
Molecular Weight
151.15 g/mol
Controlled
No

Chemical Information

3-(Difluoromethoxy)piperidine
CAS Number1240528-91-9
PubChem CID47003318
IUPAC Name3-(difluoromethoxy)piperidine
Molecular FormulaC6H11F2NO
Molecular Weight151.15
XLogP1.2
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity99
SMILES
C1CC(CNC1)OC(F)F
InChI
InChI=1S/C6H11F2NO/c7-6(8)10-5-2-1-3-9-4-5/h5-6,9H,1-4H2
InChIKey
RFLBTFBEDGNWFK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(Difluoromethoxy)piperidine
CAS: 1240528-91-9
CID: 47003318
Formula: C6H11F2NO
MW: 151.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight151.15
XLogP31.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass151.08087030
Monoisotopic Mass151.08087030
Topological Polar Surface Area21.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity99.7
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

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CatalogName
TRC-D452958-100MG4-(Difluoromethoxy)piperidine
PC484453- (Difluoromethoxy) piperidine
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sc-333422A1-[2- (difluoromethoxy) benzoyl]piperidine-3-carboxylic acid
PC4117-01(Difluoromethoxy) benzene
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