Pyributicarb

Base Information

• Chemical Name: Pyributicarb
• CAS No.: 88678-67-5
• Deprecated CAS: 140908-77-6
• Molecular Formula: C18H22 N2 O2 S
• Molecular Weight: 330.48
• Hs Code.: 29333990
• European Community (EC) Number: 618-200-7
• UNII: EZI481Y8N1
• DSSTox Substance ID: DTXSID2058209
• Nikkaji Number: J319.683F
• Wikidata: Q19298808
• Mol file: 88678-67-5.mol

Synonyms:Pyributicarb;88678-67-5;TSH-888;Pyributicarb [ISO];o-3-tert-butylphenyl 6-methoxy-2-pyridyl(methyl)thiocarbamate;O-(3-tert-butylphenyl) N-(6-methoxypyridin-2-yl)-N-methylcarbamothioate;EZI481Y8N1;O-3-tert-Butylphenyl (6-methoxy-2-pyridyl)(methyl)thiocarbamate;Carbamothioic acid, (6-methoxy-2-pyridinyl)methyl-, O-(3-(1,1-dimethylethyl)phenyl) ester;O-[3-(1,1-dimethylethyl)phenyl] N-(6-methoxy-2-pyridinyl)-N-methylcarbamothioate;Thiocarbamic acid, N-(6-methoxy-2-pyridyl)-N-methyl-, O-3-tert-butylphenyl ester;pyributicarbe;O-(3-(1,1-DIMETHYLETHYL)PHENYL) N-(6-METHOXY-2-PYRIDINYL)-N-METHYLCARBAMOTHIOATE;ISSHINTASUKE;UNII-EZI481Y8N1;SCHEMBL66272;DTXSID2058209;CHEBI:81736;EX-A4246;MFCD30541350;AKOS030228032;AS-76497;HY-111202;LS-152594;CS-0034633;C18422;Q19298808;O-(3-tert-butylphenyl) (6-methoxypyridin-2-yl)methylcarbamothioate;O-(3-(tert-Butyl)phenyl) (6-methoxypyridin-2-yl)(methyl)carbamothioate;CARBAMOTHIOIC ACID, N-(6-METHOXY-2-PYRIDINYL)-N-METHYL-, O-(3-(1,1-DIMETHYLETHYL)PHENYL) ESTER

Chemical Property of Pyributicarb

Chemical Property:

• Vapor Pressure: 1.6E-07mmHg at 25°C
• Melting Point: 85～88℃
• Refractive Index: 1.6000 (estimate)
• Boiling Point: 427.8oC at 760 mmHg
• PKA: 1.22±0.10(Predicted)
• Flash Point: 212.5oC
• PSA: 75.47000
• Density: 1.16g/cm3
• LogP: 4.23210
• Storage Temp.: 0-6°C
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 330.14019912
• Heavy Atom Count: 23
• Complexity: 397

Purity/Quality:

98%min ^*data from raw suppliers

Pyributicarb ^*data from reagent suppliers

Safty Information:

• Pictogram(s): N
• Hazard Codes: N
• Statements: 50/53
• Safety Statements: 61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)C1=CC(=CC=C1)OC(=S)N(C)C2=NC(=CC=C2)OC
• Uses: Pyributicarb, is a carbamate-type herbicide, acting as a potent activator of both CYP3A4 gene and human pregnane X receptor (hPXR).