Cas no 58700-99-5 (Butanoic acid, 2-(methoxymethylene)-3-oxo-, methyl ester)
58700-99-5 structure
Product Name:Butanoic acid, 2-(methoxymethylene)-3-oxo-, methyl ester
CAS No:58700-99-5
MF:C7H10O4
MW:158.151902675629
CID:341188
PubChem ID:54260517
Update Time:2025-04-19
Butanoic acid, 2-(methoxymethylene)-3-oxo-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 2-(methoxymethylene)-3-oxo-, methyl ester
- methyl 2-(methoxymethylidene)-3-oxobutanoate
- methyl alpha-methoxymethyleneacetoacetate
- Methyl 2-(Methoxymethylene)-3-oxobutanoate
- methyl 2-methoxymethylene-3-oxobutanoate
- 58700-99-5
- RDEHDFHNQPTQFC-UHFFFAOYSA-N
- SY330734
-
- Inchi： 1S/C7H10O4/c1-5(8)6(4-10-2)7(9)11-3/h4H,1-3H3
- InChI Key： RDEHDFHNQPTQFC-UHFFFAOYSA-N
- SMILES： O(C)C(C(=COC)C(C)=O)=O
Computed Properties
- Exact Mass: 158.0579
- Monoisotopic Mass: 158.05790880g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 193
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 0.2
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
Butanoic acid, 2-(methoxymethylene)-3-oxo-, methyl ester Related Literature
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2. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
58700-99-5 (Butanoic acid, 2-(methoxymethylene)-3-oxo-, methyl ester) Related Products
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