Cas no 19910-30-6 (Butanoic acid,2,3,3-trimethyl-, methyl ester)
19910-30-6 structure
Product Name:Butanoic acid,2,3,3-trimethyl-, methyl ester
CAS No:19910-30-6
MF:C8H16O2
MW:144.211442947388
CID:160837
PubChem ID:140630
Update Time:2025-04-19
Butanoic acid,2,3,3-trimethyl-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid,2,3,3-trimethyl-, methyl ester
- methyl 2,3,3-trimethylbutanoate
- 2,3,3-Trimethylbutanoic acid methyl ester
- Butanoic acid, 2,3,3-trimethyl-, methyl ester
- SCHEMBL7434659
- 19910-30-6
- Methyl 2,3,3-trimethylbutyrate
- HLKQGJVFPKYPQN-UHFFFAOYSA-N
- 2,3,3-trimethyl-butyric acid methyl ester
- DTXSID20941789
-
- Inchi： 1S/C8H16O2/c1-6(7(9)10-5)8(2,3)4/h6H,1-5H3
- InChI Key： HLKQGJVFPKYPQN-UHFFFAOYSA-N
- SMILES： O(C)C(C(C)C(C)(C)C)=O
Computed Properties
- Exact Mass: 144.11508
- Monoisotopic Mass: 144.115
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 122
- 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: 2.3
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- Density: 0.876
- Boiling Point: 132.1°C at 760 mmHg
- Flash Point: 33.2°C
- Refractive Index: 1.41
- PSA: 26.3
Butanoic acid,2,3,3-trimethyl-, methyl ester Related Literature
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1. Stereochemistry of addition to the carbonyl group. Part 17. Study of the factors affecting asymmetric induction in condensation reactions of methyl- and phenyl-magnesium bromide with chiral carbonyl compoundsOdon Arjona,Rafael Pérez-Ossorio,Alfredo Pérez-Rubalcaba,Maria L. Quiroga J. Chem. Soc. Perkin Trans. 2 1981 597
19910-30-6 (Butanoic acid,2,3,3-trimethyl-, methyl ester) Related Products
- 10250-48-3(Methyl tert-Butylacetate)
- 2177-77-7(Methyl 2-methylvalerate)
- 711-01-3(1-Adamantanecarboxylic Acid Methyl Ester)
- 868-57-5(DL-2-Methylbutyric Acid Methyl Ester)
- 1459-95-6(Dimethyl adamantane-1,3-dicarboxylate)
- 32980-26-0(4-Methoxy-3,3-dimethyl-4-oxobutanoic acid)
- 19780-94-0(Dimethyl 2-methylhexanedioate)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
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