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4- (Allyloxy) piperidine hydrochloride

CAT: 0926-GNB32463-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0926-GNB32463-01Size:100 mg
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CAS Number
956324-63-3
MDL Number
MFCD11506393
Smiles
C=CCOC1CCNCC1.Cl
Molecular Formula
C8H16ClNO
Molecular Weight
177.68 g/mol
Controlled
No

Chemical Information

4-(Allyloxy)piperidine hydrochloride
CAS Number956324-63-3
PubChem CID46735673
IUPAC Name4-prop-2-enoxypiperidine;hydrochloride
Molecular FormulaC8H16ClNO
Molecular Weight177.67
Topological Polar Surface Area21.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count11
Formal Charge0
Complexity97
SMILES
C=CCOC1CCNCC1.Cl
InChI
InChI=1S/C8H15NO.ClH/c1-2-7-10-8-3-5-9-6-4-8;/h2,8-9H,1,3-7H2;1H
InChIKey
WHSPMDGTUJSSPI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-(Allyloxy)piperidine hydrochloride
CAS: 956324-63-3
CID: 46735673
Formula: C8H16ClNO
MW: 177.67
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight177.67
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass177.0920418
Monoisotopic Mass177.0920418
Topological Polar Surface Area21.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity97.4
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes