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4- (Dimethoxymethyl) piperidine

CAT: 0127-OR75896-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR75896-01Size:1 g
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CAS Number
188646-83-5
MDL Number
MFCD09991908
Purity
98%
Smiles
COC(C1CCNCC1)OC

Chemical Information

4-(Dimethoxymethyl)piperidine
CAS Number188646-83-5
PubChem CID18678521
IUPAC Name4-(dimethoxymethyl)piperidine
Molecular FormulaC8H17NO2
Molecular Weight159.23
XLogP0.4
Topological Polar Surface Area30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count11
Formal Charge0
Complexity98
SMILES
COC(C1CCNCC1)OC
InChI
InChI=1S/C8H17NO2/c1-10-8(11-2)7-3-5-9-6-4-7/h7-9H,3-6H2,1-2H3
InChIKey
XYPNDIREOHZKFS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(Dimethoxymethyl)piperidine
CAS: 188646-83-5
CID: 18678521
Formula: C8H17NO2
MW: 159.23
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight159.23
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass159.125928785
Monoisotopic Mass159.125928785
Topological Polar Surface Area30.5 Ų
Heavy Atom Count11
Formal Charge0
Complexity98.3
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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