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Pyributicarb

CAT: 1459-CS-ED-01871Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-ED-01871Size:1 Each
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Description
Pyributicarb is listed under Pesticide Standards and is intended for analytical research, quality control and pharmaceutical reference standard applications. The product is supplied by Clearsynth under CAT No. CS-ED-01871. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
88678-67-5
Synonyms
Pyributicarb
Molecular Formula
C 18 H 22 N 2 O 2 S
Molecular Weight
330.4
Additionnal Information
Pyributicarb is supplied with detailed characterization data compliant with regulatory guideline. Pyributicarb can be used for analytical method development, method validation (AMV), Quality Control (QC), ANDA-related analytical work, and commercial pharmaceutical research applications.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

Pyributicarb

Pyributicarb is a monothiocarbamic ester that is carbamic acid in which the oxygen of the oxo group is replaced by sulfur, the hydrogens attached to the nitrogen are replaced by methyl and 6-methoxypyridin-2-yl groups, and the hydrogen of the hydroxy group is replaced by a p-tert-butylphenyl group. It has fungicidal and herbicidal activity and is used in paddy rice and turf production. It has a role as a herbicide, a sterol biosynthesis inhibitor and an antifungal agrochemical. It is a member of pyridines, an aromatic ether and a monothiocarbamic ester.

CAS Number88678-67-5
PubChem CID93486
IUPAC NameO-(3-tert-butylphenyl) N-(6-methoxy-2-pyridinyl)-N-methylcarbamothioate
Molecular FormulaC18H22N2O2S
Molecular Weight330.4
XLogP5.2
Topological Polar Surface Area66.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count23
Formal Charge0
Complexity397
SMILES
CC(C)(C)C1=CC(=CC=C1)OC(=S)N(C)C2=NC(=CC=C2)OC
InChI
InChI=1S/C18H22N2O2S/c1-18(2,3)13-8-6-9-14(12-13)22-17(23)20(4)15-10-7-11-16(19-15)21-5/h6-12H,1-5H3
InChIKey
VTRWMTJQBQJKQH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyributicarb
CAS: 88678-67-5
CID: 93486
Formula: C18H22N2O2S
MW: 330.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight330.4
XLogP35.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass330.14019912
Monoisotopic Mass330.14019912
Topological Polar Surface Area66.7 Ų
Heavy Atom Count23
Formal Charge0
Complexity397
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

Alternative Products

CatalogName
MBS5758508Pyributicarb
HY-111202RPyributicarb (Standard)
A19393-500Pyributicarb 500mg
A19393-50Pyributicarb 50mg
A19393-25Pyributicarb 25mg
A19393-100Pyributicarb 100mg
A19393-10mM-DPyributicarb 10mM * 1mL in DMSO

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