Cas no 7561-23-1 (Pentanoic acid, 3-mercapto-)
Pentanoic acid, 3-mercapto- structure
Product Name:Pentanoic acid, 3-mercapto-
CAS No:7561-23-1
MF:C5H10O2S
MW:134.196700572968
CID:539268
PubChem ID:480008
Update Time:2025-04-19
Pentanoic acid, 3-mercapto- Chemical and Physical Properties
Names and Identifiers
-
- Pentanoic acid, 3-mercapto-
- 3-sulfanylpentanoic acid
- 3-mercapto-valeric acid
- 3-mercaptovaleric acid
- 7561-23-1
- DTXSID20333069
- AKOS012399396
- SCHEMBL869031
- .beta.-Ethyl mercapto propionic acid
-
- Inchi： 1S/C5H10O2S/c1-2-4(8)3-5(6)7/h4,8H,2-3H2,1H3,(H,6,7)
- InChI Key： PTPQZNNAUUSACC-UHFFFAOYSA-N
- SMILES： SC(CC(=O)O)CC
Computed Properties
- Exact Mass: 134.0402
- Monoisotopic Mass: 134.04015073g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 8
- Rotatable Bond Count: 3
- Complexity: 82.5
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 38.3?2
Experimental Properties
- PSA: 37.3
Pentanoic acid, 3-mercapto- Related Literature
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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