Cas no 22228-82-6 (Propanoic acid,2-methyl-, ammonium salt (1:1))
22228-82-6 structure
Product Name:Propanoic acid,2-methyl-, ammonium salt (1:1)
CAS No:22228-82-6
MF:C4H11NO2
MW:105.135641336441
CID:250553
PubChem ID:168034
Update Time:2025-04-19
Propanoic acid,2-methyl-, ammonium salt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid,2-methyl-, ammonium salt (1:1)
- azanium,2-methylpropanoate
- ammonium 2-methylpropanoate
- Ammonium isobutyrate
- Caswell No. 044AA
- EPA Pesticide Chemical Code 101501
- GR-9234
- Propanoic acid, 2-methyl-, ammonium salt
- UNII-3F03259M1O
- EINECS 244-850-2
- 22228-82-6
- 3F03259M1O
- isobutyric acid, ammonium salt
- Q27257129
- NS00084133
- DTXSID2066771
- SCHEMBL929931
- Propanoic acid, 2-methyl-, ammonium salt (1:1)
-
- Inchi： 1S/C4H8O2.H3N/c1-3(2)4(5)6;/h3H,1-2H3,(H,5,6);1H3
- InChI Key： MDUBPQGQPBQGGN-UHFFFAOYSA-N
- SMILES： [O-]C(C(C)C)=O.[NH4+]
Computed Properties
- Exact Mass: 105.07903
- Monoisotopic Mass: 105.078978594g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 7
- Rotatable Bond Count: 0
- Complexity: 51.1
- 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: 41.1?2
Experimental Properties
- PSA: 76.63
Propanoic acid,2-methyl-, ammonium salt (1:1) Related Literature
-
1. 498. Coenzyme A. Part II. Evidence for its formulation as a derivative of pantothenic acid-4′ phosphateJ. Baddiley,E. M. Thain J. Chem. Soc. 1951 2253
-
2. Cytidine nucleotides. Part I. Isolation from lactobacillus arabinosusJ. Baddiley,A. P. Mathias J. Chem. Soc. 1954 2723
-
3. 753. Coenzyme A. Part III. Synthesis of pantothenic acid-2′ : 4′ phosphate and further structural considerationsJ. Baddiley,E. M. Thain J. Chem. Soc. 1951 3421
-
4. Organic chemistry
-
5. 506. The nucleotide sequence in deoxypentosenucleic acids. Part II. The alkaline degradation of calf-thymus aldehydoapurinic acid di(carboxymethyl) dithioacetalA. S. Jones,D. S. Letham,M. Stacey J. Chem. Soc. 1956 2579
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