Cas no 174872-90-3 (propyl (phenylsulfanyl)acetate)
174872-90-3 structure
Product Name:propyl (phenylsulfanyl)acetate
CAS No:174872-90-3
MF:C11H14O2S
MW:210.292662143707
CID:1367907
PubChem ID:177292
Update Time:2025-04-20
propyl (phenylsulfanyl)acetate Chemical and Physical Properties
Names and Identifiers
-
- propyl (phenylsulfanyl)acetate
- Acetic acid, (phenylthio)-, propyl ester
- Propyl (phenylthio)acetate
- propyl 2-phenylsulfanylacetate
- 174872-90-3
- (Phenylthio)acetic acid, propyl ester
- AKOS017265496
- PGNCCKPNZYBMHV-UHFFFAOYSA-N
- DTXSID60938592
-
- Inchi： 1S/C11H14O2S/c1-2-8-13-11(12)9-14-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
- InChI Key： PGNCCKPNZYBMHV-UHFFFAOYSA-N
- SMILES： S(C1C=CC=CC=1)CC(=O)OCCC
Computed Properties
- Exact Mass: 210.07152
- Monoisotopic Mass: 210.071
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 165
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.2
- Topological Polar Surface Area: 51.6?2
Experimental Properties
- Density: 1.1
- Boiling Point: 293.1°C at 760 mmHg
- Flash Point: 130.2°C
- Refractive Index: 1.542
- PSA: 26.3
propyl (phenylsulfanyl)acetate Related Literature
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
-
Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
-
Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
174872-90-3 (propyl (phenylsulfanyl)acetate) Related Products
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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