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2,6-Dimethylpiperidine

CAT: 0024-sc-507061Size: 5 gDry Ice: NoHazardous: No
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CAT#:0024-sc-507061Size:5 g
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CAS Number
504-03-0

Chemical Information

Nanofin

RN given refers to parent cpd; structure

CAS Number504-03-0
PubChem CID68843
IUPAC Name2,6-dimethylpiperidine
Molecular FormulaC7H15N
Molecular Weight113.20
XLogP1.5
Topological Polar Surface Area12
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity62
SMILES
CC1CCCC(N1)C
InChI
InChI=1S/C7H15N/c1-6-4-3-5-7(2)8-6/h6-8H,3-5H2,1-2H3
InChIKey
SDGKUVSVPIIUCF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nanofin
CAS: 504-03-0
CID: 68843
Formula: C7H15N
MW: 113.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight113.20
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass113.120449483
Monoisotopic Mass113.120449483
Topological Polar Surface Area12 Ų
Heavy Atom Count8
Formal Charge0
Complexity62.8
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes