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Butachlor

CAT: 0931-T30618-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T30618-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
23184-66-9
Target
Others
Related Pathways
Others
Purity
0.9997
Bioactivity
Butachlor is a pre-emergence herbicide effective against annual grasses and select broadleaf weeds, exhibiting moderate aqueous solubility, low volatility, and moderate persistence under certain soil conditions. Butachlor shows moderate oral mammalian toxicity, is a skin and eye irritant, and displays low toxicity to honeybees, making Butachlor a well-characterized compound for environmental, toxicological, and agricultural research.
Smiles
O=C(N(C=1C(=CC=CC1CC)CC)COCCCC)CCl
Molecular Formula
C17H26ClNO2
Molecular Weight
311.85
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Butachlor

Butachlor is an aromatic amide that is 2-choro-N-(2,6-diethylphenyl)acetamide in which the amide nitrogen has been replaced by a butoxymethyl group. It has a role as a herbicide, a xenobiotic and an environmental contaminant. It is a tertiary carboxamide, an organochlorine compound and an aromatic amide. It is functionally related to a N-phenylacetamide.

CAS Number23184-66-9
PubChem CID31677
IUPAC NameN-(butoxymethyl)-2-chloro-N-(2,6-diethylphenyl)acetamide
Molecular FormulaC17H26ClNO2
Molecular Weight311.8
XLogP4.5
Topological Polar Surface Area29.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Heavy Atom Count21
Formal Charge0
Complexity287
SMILES
CCCCOCN(C1=C(C=CC=C1CC)CC)C(=O)CCl
InChI
InChI=1S/C17H26ClNO2/c1-4-7-11-21-13-19(16(20)12-18)17-14(5-2)9-8-10-15(17)6-3/h8-10H,4-7,11-13H2,1-3H3
InChIKey
HKPHPIREJKHECO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Butachlor
CAS: 23184-66-9
CID: 31677
Formula: C17H26ClNO2
MW: 311.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight311.8
XLogP34.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Exact Mass311.1652068
Monoisotopic Mass311.1652068
Topological Polar Surface Area29.5 Ų
Heavy Atom Count21
Formal Charge0
Complexity287
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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