Methyl 2-isothiocyanato-5-methyl-4-phenylthiophene-3-carboxylate structure

Methyl 2-isothiocyanato-5-methyl-4-phenylthiophene-3-carboxylate

methyl 2-isothiocyanato-5-methyl-4-phenylthiophene-3-carboxylate

Also Known As: methyl 2-isothiocyanato-5-methyl-4-phenylthiophene-3-carboxylate|Z-0622|Benzaldehyde,5-chloro-2-[(3-methyl-2-butenyl)oxy]|Methyl 2-isothiocyanato-5-methyl-4-phenyl-thiophene-3-carboxylate

CAS: 588682-00-2
Molecular Formula C14H11NO2S2
Molecular Weight 289.02313 g/mol
LogP 4.24442
Topological Polar Surface Area 38.66 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 289.02313
Monoisotopic Mass 289.02313
Heavy Atoms 19
Complexity 655.5855

Chemical Identifiers

CAS Number 588682-00-2
SMILES CC1=C(C(=C(S1)N=C=S)C(=O)OC)C2=CC=CC=C2

Product Overview

Methyl 2-isothiocyanato-5-methyl-4-phenylthiophene-3-carboxylate (CAS 588682-00-2), with molecular formula C14H11NO2S2 and molecular weight 289.02313 g/mol. IUPAC: methyl 2-isothiocyanato-5-methyl-4-phenylthiophene-3-carboxylate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Methyl 2-isothiocyanato-5-methyl-4-phenylthiophene-3-carboxylate is a custom synthesis product. We offer services from milligram to kilogram scale.

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