Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, cyclopentyl ester

Base Information

• Chemical Name: Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, cyclopentyl ester
• CAS No.: 165391-83-3
• Molecular Formula: C18H18 Cl N O3 S
• Molecular Weight: 363.8584
• NSC Number: 641635
• DSSTox Substance ID: DTXSID30167938
• Nikkaji Number: J672.468J
• ChEMBL ID: CHEMBL103164
• Mol file: 165391-83-3.mol

Synonyms:UC42;UC 42;UC-42;NSC 641635;165391-83-3;NSC641635;Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, cyclopentyl ester;Benzoic acid, cyclopentyl ester;CHEMBL103164;DTXSID30167938;cyclopentyl 2-chloro-5-[(2-methylfuran-3-carbothioyl)amino]benzoate;NSC-641635;Benzoic acid, 2-chloro-5-[[(2-methyl-3-furanyl)thioxomethyl]amino]-, cyclopentyl ester

Chemical Property of Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, cyclopentyl ester

Chemical Property:

• Vapor Pressure: 2.2E-09mmHg at 25°C
• Boiling Point: 480.2°Cat760mmHg
• Flash Point: 244.2°C
• Density: 1.34g/cm³
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 363.0695923
• Heavy Atom Count: 24
• Complexity: 469

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)C(=O)OC3CCCC3

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