Cas no 70776-74-8 (Propanoic acid,3-mercapto-, ammonium salt (1:1))
70776-74-8 structure
Product Name:Propanoic acid,3-mercapto-, ammonium salt (1:1)
CAS No:70776-74-8
MF:C3H9NO2S
MW:123.17405962944
CID:569135
PubChem ID:172617
Update Time:2025-04-19
Propanoic acid,3-mercapto-, ammonium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,3-mercapto-, ammonium salt (1:1)
- ammonium 3-mercaptopropionate
- azanium,3-sulfanylpropanoate
- 3-Mercaptopropionic acid, ammonium salt
- ammonium 3-sulfanylpropanoate
- Propanoic acid, 3-mercapto-, monoammonium salt
- Propanoic acid, 3-mercapto-, ammonium salt (1:1)
- Ammonium mercaptopropionate
- Ammonium 3-thiopropionate
- DTXSID80887255
- 70776-74-8
- SCHEMBL4990321
- NS00092227
- EINECS 274-879-6
- 57862-95-0
-
- Inchi： 1S/C3H6O2S.H3N/c4-3(5)1-2-6;/h6H,1-2H2,(H,4,5);1H3
- InChI Key： HCTNQQPHPIGLQV-UHFFFAOYSA-N
- SMILES： SCCC(=O)[O-].[NH4+]
Computed Properties
- Exact Mass: 123.03547
- Monoisotopic Mass: 123.03539970g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 7
- Rotatable Bond Count: 1
- Complexity: 47.2
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 42.1?2
Experimental Properties
- PSA: 76.63
Propanoic acid,3-mercapto-, ammonium salt (1:1) Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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