Cas no 61355-87-1 (Butanoic acid, 2-ethyl-2-hydroxy-3-methyl-)
61355-87-1 structure
Product Name:Butanoic acid, 2-ethyl-2-hydroxy-3-methyl-
CAS No:61355-87-1
MF:C7H14O3
MW:146.184262752533
CID:482579
PubChem ID:23422674
Update Time:2025-04-19
Butanoic acid, 2-ethyl-2-hydroxy-3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 2-ethyl-2-hydroxy-3-methyl-
- 2-ethyl-2-hydroxy-3-methylbutanoic acid
- AKOS006383490
- DTXSID00633852
- SCHEMBL17008763
- 61355-87-1
-
- Inchi： 1S/C7H14O3/c1-4-7(10,5(2)3)6(8)9/h5,10H,4H2,1-3H3,(H,8,9)
- InChI Key： UIMWZOUSAYQHNN-UHFFFAOYSA-N
- SMILES： OC(C(=O)O)(CC)C(C)C
Computed Properties
- Exact Mass: 146.09432
- Monoisotopic Mass: 146.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 131
- 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: 1.2
- Topological Polar Surface Area: 57.5?2
Experimental Properties
- PSA: 57.53
Butanoic acid, 2-ethyl-2-hydroxy-3-methyl- Related Literature
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
61355-87-1 (Butanoic acid, 2-ethyl-2-hydroxy-3-methyl-) Related Products
- 5949-29-1(Citric acid monohydrate)
- 6100-05-6(Potassium citrate monohydrate)
- 10402-15-0(Copper Citrate)
- 77-92-9(Citric acid)
- 77-95-2(D(-)-Quinic Acid)
- 3012-65-5(Diammonium hydrogen citrate)
- 1123-28-0(1-Hydroxycyclohexanecarboxylic acid)
- 6205-14-7(Hydroxycitric Acid (Technical Grade))
- 7778-49-6(Potassium citrate)
- 3739-30-8(2-Hydroxy-2-methylbutyric acid)
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