Cas no 49714-52-5 (2,2,3-trimethylbutanoic acid)

2,2,3-Trimethylbutanoic acid is a branched-chain carboxylic acid with the molecular formula C7H14O2. It features a highly substituted carbon backbone, which contributes to its steric hindrance and influences its reactivity and physical properties. This compound is characterized by its clear, colorless appearance and a distinct carboxylic acid functional group, making it useful in organic synthesis, particularly in the preparation of esters and other derivatives. Its branched structure enhances thermal stability and resistance to oxidation, making it suitable for applications requiring robust chemical intermediates. Additionally, 2,2,3-trimethylbutanoic acid can serve as a precursor in pharmaceuticals and agrochemicals, where its unique structure may impart desirable biological activity or metabolic stability.
2,2,3-trimethylbutanoic acid structure
2,2,3-trimethylbutanoic acid structure
Product Name:2,2,3-trimethylbutanoic acid
CAS No:49714-52-5
MF:C7H14O2
MW:130.184862613678
MDL:MFCD02258749
CID:331572
PubChem ID:639797
Update Time:2025-07-02

2,2,3-trimethylbutanoic acid Chemical and Physical Properties

Names and Identifiers

    • Butanoic acid,2,2,3-trimethyl-
    • 2,2,3-TRIMETHYLBUTANOIC ACID
    • 2,2,3-Trimethylbutancarbonsaeure
    • 2,2,3-Trimethylbutansaeure
    • 2,2,3-Trimethyl-buttersaeure
    • 2,2,3-trimethyl-butyric acid
    • Butanoic acid,2,2,3-trimethyl
    • EINECS 256-441-6
    • 2,2,3-trimethylbutanoicacid
    • butanoic acid, 2,2,3-trimethyl-
    • EN300-93467
    • SCHEMBL209810
    • DTXSID10197990
    • InChI=1/C7H14O2/c1-5(2)7(3,4)6(8)9/h5H,1-4H3,(H,8,9
    • Z1198160164
    • AKOS006276604
    • CS-0264607
    • 49714-52-5
    • MLFLWIBXZIPYEI-UHFFFAOYSA-N
    • NS00031945
    • 2,2,3-Trimethylbutyric acid
    • DB-089631
    • G57988
    • 2,2,3-trimethylbutanoic acid
    • MDL： MFCD02258749
    • Inchi： 1S/C7H14O2/c1-5(2)7(3,4)6(8)9/h5H,1-4H3,(H,8,9)
    • InChI Key： MLFLWIBXZIPYEI-UHFFFAOYSA-N
    • SMILES： OC(C(C)(C)C(C)C)=O

Computed Properties

  • Exact Mass: 130.09900
  • Monoisotopic Mass: 130.09938
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 2
  • Complexity: 114
  • 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
  • Topological Polar Surface Area: 37.3
  • XLogP3: 2

Experimental Properties

  • Density: 0.935
  • Boiling Point: 203.6°Cat760mmHg
  • Flash Point: 88.5°C
  • Refractive Index: 1.43
  • PSA: 37.30000
  • LogP: 1.75320

2,2,3-trimethylbutanoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
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 $ 50.00 2022-06-07
TRC
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 $ 160.00 2022-06-07
TRC
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 $ 250.00 2022-06-07
Enamine
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Enamine
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Enamine
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Enamine
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Enamine
EN300-93467-2.5g
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Enamine
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2,2,3-trimethylbutanoic acid Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:49714-52-5)2,2,3-trimethylbutanoic acid
Order Number:A1087363
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 19:29
Price ($):1076.0

2,2,3-trimethylbutanoic acid Related Literature

  • 1. 449. Reactions of unsaturated compounds. Part XIV. The oxidation of 2 : 2 : 4 : 6 : 6-pentamethylhept-3-ene
    M. A. Davis,W. J. Hickinbottom J. Chem. Soc. 1958 2205
  • 2. Asymmetric induction in addition of N-nitrenes to alkenes: oxidation of 3-amino-2-(1,2,2-trimethylpropyl)quinazolin-4(3H)-one in the presence of α-methylene-γ-butyrolactone: conformational analysis of the aziridines formed and comparison with alkanoylated cyclopropylamines
    Robert S. Atkinson,Gary Tughan J. Chem. Soc. Perkin Trans. 1 1987 2797

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49714-52-5 (2,2,3-trimethylbutanoic acid) Related Products

Recommended suppliers
Amadis Chemical Company Limited
(CAS:49714-52-5)2,2,3-trimethylbutanoic acid
A1087363
Purity:99%
Quantity:1g
Price ($):1076.0
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