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1,3-Diethylpiperazine

CAT: 0926-AKC02354-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0926-AKC02354-01Size:50 mg
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CAS Number
1500023-54-0
MDL Number
MFCD20426933
Smiles
CCC1CN (CCN1) CC
Molecular Formula
C8H18N2
Molecular Weight
142.24 g/mol
Controlled
No

Chemical Information

1,3-Diethylpiperazine
CAS Number1500023-54-0
PubChem CID54380553
IUPAC Name1,3-diethylpiperazine
Molecular FormulaC8H18N2
Molecular Weight142.24
XLogP0.9
Topological Polar Surface Area15.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count10
Formal Charge0
Complexity93
SMILES
CCC1CN(CCN1)CC
InChI
InChI=1S/C8H18N2/c1-3-8-7-10(4-2)6-5-9-8/h8-9H,3-7H2,1-2H3
InChIKey
UZOVIHCILYKHPQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1,3-Diethylpiperazine
CAS: 1500023-54-0
CID: 54380553
Formula: C8H18N2
MW: 142.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight142.24
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass142.146998583
Monoisotopic Mass142.146998583
Topological Polar Surface Area15.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity93.3
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