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Also known as: 188646-83-5, Piperidine, 4-(dimethoxymethyl)-, 4-(dimethoxymethyl)-piperidine, Mfcd09991908, Schembl1689631, Dtxsid70595539
Molecular Formula
C8H17NO2
Molecular Weight
159.23  g/mol
InChI Key
XYPNDIREOHZKFS-UHFFFAOYSA-N

188646-83-5
1 2D Structure

188646-83-5

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4-(dimethoxymethyl)piperidine
2.1.2 InChI
InChI=1S/C8H17NO2/c1-10-8(11-2)7-3-5-9-6-4-7/h7-9H,3-6H2,1-2H3
2.1.3 InChI Key
XYPNDIREOHZKFS-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC(C1CCNCC1)OC
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 188646-83-5

2. Piperidine, 4-(dimethoxymethyl)-

3. 4-(dimethoxymethyl)-piperidine

4. Mfcd09991908

5. Schembl1689631

6. Dtxsid70595539

7. Akos006311334

8. Sy278575

9. Ws-02474

10. E74114

11. En300-1738099

12. A903636

2.3 Create Date
2007-12-04
3 Chemical and Physical Properties
Molecular Weight 159.23 g/mol
Molecular Formula C8H17NO2
XLogP30.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass g/mol
Monoisotopic Mass g/mol
Topological Polar Surface Area30.5
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

BUILDING BLOCK

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