Cas no 13291-41-3 (Benzenecarbothioic acid, S-(1-methylethyl) ester)
13291-41-3 structure
Product Name:Benzenecarbothioic acid, S-(1-methylethyl) ester
CAS No:13291-41-3
MF:C10H12OS
MW:180.266681671143
CID:1231828
Update Time:2024-08-04
Benzenecarbothioic acid, S-(1-methylethyl) ester Chemical and Physical Properties
Names and Identifiers
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- Benzenecarbothioic acid, S-(1-methylethyl) ester
- S-isopropyl benzothioate
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- Inchi： 1S/C10H12OS/c1-8(2)12-10(11)9-6-4-3-5-7-9/h3-8H,1-2H3
- InChI Key： HPIFWVFTPJZGSI-UHFFFAOYSA-N
- SMILES： C1(C(SC(C)C)=O)=CC=CC=C1
Computed Properties
- Exact Mass: 180.06096
Experimental Properties
- Density: 1.070±0.06 g/cm3(Predicted)
- Boiling Point: 247.4±13.0 °C(Predicted)
- PSA: 17.07
Benzenecarbothioic acid, S-(1-methylethyl) ester Related Literature
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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