Cas no 16849-77-7 (Propionic acid, 2-mercapto-, isopropyl ester)
16849-77-7 structure
Product Name:Propionic acid, 2-mercapto-, isopropyl ester
CAS No:16849-77-7
MF:C6H12O2S
MW:148.223280906677
CID:2658636
Update Time:2023-08-06
Propionic acid, 2-mercapto-, isopropyl ester Chemical and Physical Properties
Names and Identifiers
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- 2-Mercaptopropionic acid 1-methylethyl ester
- propan-2-yl 2-sulfanylpropanoate
- Propionic acid, 2-mercapto-, isopropyl ester
- NUIVLBRODXOUAB-UHFFFAOYSA-N
- Propanoic acid, 2-mercapto-, 1-methylethyl ester
- Isopropyl 2-sulfanylpropanoate #
- Isopropyl-alpha-mercapto-propionate
- Isopropyl .alpha.-mercaptopropionate
-
- Inchi: 1S/C6H12O2S/c1-4(2)8-6(7)5(3)9/h4-5,9H,1-3H3
- InChI Key: NUIVLBRODXOUAB-UHFFFAOYSA-N
- SMILES: SC(C)C(=O)OC(C)C
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 101
- XLogP3: 1.6
- Topological Polar Surface Area: 27.3
Propionic acid, 2-mercapto-, isopropyl ester Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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