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Fenobucarb

CAT: 1299-RM-F640100-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-F640100-02Size:25 mg
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CAS Number
3766-81-2
Synonyms
2- (sec-butyl) phenyl methylcarbamate
Molecular Formula
C12H17NO2
Molecular Weight
207.27
Target Alternative Name
Fenobucarb
Product Name Synonym
2- (sec-butyl) phenyl methylcarbamate

Chemical Information

Fenobucarb

Fenobucarb is a carbamate ester obtained by the formal condensation of 2-sec-butylphenol with methylcarbamic acid. It has a role as a herbicide, an insecticide, an agrochemical, an EC 3.1.1.7 (acetylcholinesterase) inhibitor and an environmental contaminant. It is functionally related to a 2-sec-butylphenol and a methylcarbamic acid.

CAS Number3766-81-2
PubChem CID19588
IUPAC Name(2-butan-2-ylphenyl) N-methylcarbamate
Molecular FormulaC12H17NO2
Molecular Weight207.27
XLogP2.8
Topological Polar Surface Area38.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count15
Formal Charge0
Complexity206
SMILES
CCC(C)C1=CC=CC=C1OC(=O)NC
InChI
InChI=1S/C12H17NO2/c1-4-9(2)10-7-5-6-8-11(10)15-12(14)13-3/h5-9H,4H2,1-3H3,(H,13,14)
InChIKey
DIRFUJHNVNOBMY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fenobucarb
CAS: 3766-81-2
CID: 19588
Formula: C12H17NO2
MW: 207.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight207.27
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass207.125928785
Monoisotopic Mass207.125928785
Topological Polar Surface Area38.3 Ų
Heavy Atom Count15
Formal Charge0
Complexity206
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

Alternative Products

CatalogName
MBS5797299Fenobucarb
TRC-F248609-10MGFenobucarb-D3
HY-B0835R-01Fenobucarb (Standard)
S-4610-AC1000 ug/mL Fenobucarb in Acetone - 1ML

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