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2-BZP

CAT: 0804-HY-60174-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-60174-01Size:1 mg
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Description
2-BZP is a piperazine.
CAS Number
84477-71-4
Product Name Alternative
2-Benzylpiperazin
UNSPSC
12352005
Hazard Statement
H314
Target
Drug Derivative
Related Pathways
Others
Field of Research
Neurological Disease
Smiles
C1(CC2=CC=CC=C2)NCCNC1
Molecular Formula
C11H16N2
Molecular Weight
176.26
Precautions
P260-P264-P280-P301+P330+P331-P304+P340-P363-P405-P501
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

2-Benzylpiperazine
CAS Number84477-71-4
PubChem CID559033
IUPAC Name2-benzylpiperazine
Molecular FormulaC11H16N2
Molecular Weight176.26
XLogP1.2
Topological Polar Surface Area24.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity141
SMILES
C1CNC(CN1)CC2=CC=CC=C2
InChI
InChI=1S/C11H16N2/c1-2-4-10(5-3-1)8-11-9-12-6-7-13-11/h1-5,11-13H,6-9H2
InChIKey
RITMXTLCKYLIKW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Benzylpiperazine
CAS: 84477-71-4
CID: 559033
Formula: C11H16N2
MW: 176.26
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight176.26
XLogP31.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass176.131348519
Monoisotopic Mass176.131348519
Topological Polar Surface Area24.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity141
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