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Propoxur

CAT: 0931-T0976-02Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0931-T0976-02Size:1 mL - 10 mM (in DMSO)
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
114-26-1
Target
ROS, Antifungal, AChR, Nrf2, Cholinesterase (ChE), MMP, ERK
Related Pathways
Microbiology/Virology, Immunology/Inflammation, MAPK, Neuroscience, Proteases/Proteasome
Purity
0.9987
Bioactivity
Propoxur (Propoxure) is an insecticide used to control cockroaches, flies, mosquitoes, and lawn and turf insects. Acute (short-term) exposure of humans to propoxur by ingestion leads to cholinesterase inhibition of red blood cells, with mild cholinergic symptoms including blurred vision, nausea, vomiting, sweating, and tachycardia; however, the effects are transient. Chronic (long-term) inhalation exposure has resulted in depressed cholinesterase levels, headaches, vomiting, and nausea in humans. Chronic ingestion studies in animals have reported depressed cholinesterase levels, depressed body weight, effects to the liver and bladder, and a slight increase in neuropathy. No information is available on the reproductive, developmental, or carcinogenic effects of propoxur in humans. Mixed results are available from cancer studies of propoxur in animals. EPA has not classified propoxur for carcinogenicity.
Smiles
CNC(=O)Oc1ccccc1OC(C)C
Molecular Formula
C11H15NO3
Molecular Weight
209.24
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Propoxur

Propoxur can cause cancer according to The Environmental Protection Agency (EPA).

CAS Number114-26-1
PubChem CID4944
IUPAC Name(2-propan-2-yloxyphenyl) N-methylcarbamate
Molecular FormulaC11H15NO3
Molecular Weight209.24
XLogP1.5
Topological Polar Surface Area47.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity206
SMILES
CC(C)OC1=CC=CC=C1OC(=O)NC
InChI
InChI=1S/C11H15NO3/c1-8(2)14-9-6-4-5-7-10(9)15-11(13)12-3/h4-8H,1-3H3,(H,12,13)
InChIKey
ISRUGXGCCGIOQO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propoxur
CAS: 114-26-1
CID: 4944
Formula: C11H15NO3
MW: 209.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight209.24
XLogP31.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass209.10519334
Monoisotopic Mass209.10519334
Topological Polar Surface Area47.6 Ų
Heavy Atom Count15
Formal Charge0
Complexity206
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