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Piperonyl butoxide (Standard)

CAT: 0804-HY-B1198R-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-B1198R-01Size:25 mg
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Description
Piperonyl butoxide (Standard) is the analytical standard of Piperonyl butoxide. This product is intended for research and analytical applications. Piperonyl butoxide (ENT-14250) is a pesticide synergist and food additive. Piperonyl butoxide has adverse effects on reproduction, development and behavior in mice. Piperonyl butoxide can activate c-Jun and ATF-2 in mouse hepatocytes. Piperonyl butoxide is a liver cancer carcinogen in rats and mice[1][2][3].
CAS Number
51-03-6
Product Name Alternative
ENT-14250 (Standard)
UNSPSC
12352005
Hazard Statement
H302-H315-H319-H335
Target
Parasite; Reference Standards
Type
Reference compound
Related Pathways
Anti-infection; Others
Field of Research
Cancer; Infection
Assay Protocol
https://www.medchemexpress.com/piperonyl-butoxide-standard.html
Solubility
10 mM in DMSO
Smiles
CCCC1=C(COCCOCCOCCCC)C=C2OCOC2=C1
Molecular Formula
C19H30O5
Molecular Weight
338.44
Precautions
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
References & Citations
[1]Muguruma M, et al. Piperonyl butoxide activates c-Jun and ATF-2 in the hepatocytes of mice. Arch Toxicol. 2008 Oct;82 (10) :749-53.|[2]Tanaka T, et al. Effects of piperonyl butoxide on exploratory behaviour in female mice. Toxicol Ind Health. 2019 Apr;35 (4) :314-323.|[3]Takahashi O, et al. Chronic toxicity studies of piperonyl butoxide in CD-1 mice: induction of hepatocellular carcinoma. Toxicology. 1997 Dec 26;124 (2) :95-103.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards
Clinical Information
Launched

Chemical Information

Piperonyl Butoxide

Piperonyl butoxide is a member of benzodioxoles. It has a role as a pesticide synergist.

CAS Number51-03-6
PubChem CID5794
IUPAC Name5-[2-(2-butoxyethoxy)ethoxymethyl]-6-propyl-1,3-benzodioxole
Molecular FormulaC19H30O5
Molecular Weight338.4
XLogP3.7
Topological Polar Surface Area46.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Heavy Atom Count24
Formal Charge0
Complexity312
SMILES
CCCCOCCOCCOCC1=CC2=C(C=C1CCC)OCO2
InChI
InChI=1S/C19H30O5/c1-3-5-7-20-8-9-21-10-11-22-14-17-13-19-18(23-15-24-19)12-16(17)6-4-2/h12-13H,3-11,14-15H2,1-2H3
InChIKey
FIPWRIJSWJWJAI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Piperonyl Butoxide
CAS: 51-03-6
CID: 5794
Formula: C19H30O5
MW: 338.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight338.4
XLogP33.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count13
Exact Mass338.20932405
Monoisotopic Mass338.20932405
Topological Polar Surface Area46.2 Ų
Heavy Atom Count24
Formal Charge0
Complexity312
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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