Propan-2-yl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate

Base Information

• Chemical Name: Propan-2-yl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate
• CAS No.: 6103-82-8
• Molecular Formula: C12H13NO2S2
• Molecular Weight: 267.3671
• DSSTox Substance ID: DTXSID20976531
• Wikidata: Q82961450
• ChEMBL ID: CHEMBL1602711

Synonyms:MLS000061472;propan-2-yl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate;SMR000070651;isopropyl (1,3-benzothiazol-2-ylthio)acetate;6103-82-8;ChemDiv3_001545;cid_719923;CHEMBL1602711;BDBM32104;DTXSID20976531;HMS1477G05;HMS2327H15;AKOS001633882;IDI1_020511;BRD-K52690571-001-01-7;Propan-2-yl [(1,3-benzothiazol-2-yl)sulfanyl]acetate;propan-2-yl 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate;2-(1,3-benzothiazol-2-ylthio)acetic acid isopropyl ester;2-(1,3-benzothiazol-2-ylthio)acetic acid propan-2-yl ester

Chemical Property of Propan-2-yl 2-(1,3-benzothiazol-2-ylsulfanyl)acetate

Chemical Property:

• Vapor Pressure: 5.86E-06mmHg at 25°C
• Boiling Point: 379.4°Cat760mmHg
• Flash Point: 183.3°C
• Density: 1.29g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 267.03877100
• Heavy Atom Count: 17
• Complexity: 273

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MSDS Files:

Useful:

• Canonical SMILES: CC(C)OC(=O)CSC1=NC2=CC=CC=C2S1

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