3-Hydroxy-4-methyl-5H-furan-2-one - CAS 22438-62-6
Catalog: |
BB060993 |
Product Name: |
3-Hydroxy-4-methyl-5H-furan-2-one |
CAS: |
22438-62-6 |
Synonyms: |
3-Hydroxy-4-methylfuran-2(5H)-one; 3-hydroxy-4-methyl-2(5h)-furanone; 4-hydroxy-3-methyl-2H-furan-5-one; 3-hydroxy-4-methyl-2,5-dihydrofuran-2-one |
IUPAC Name: | 4-hydroxy-3-methyl-2H-furan-5-one |
Description: | 4-hydroxy-3-methyl-2H-furan-5-one (cas# 22438-62-6) is a useful research chemical. |
Molecular Weight: | 114.1 |
Molecular Formula: | C5H6O3 |
Canonical SMILES: | CC1=C(C(=O)OC1)O |
InChI: | InChI=1S/C5H6O3/c1-3-2-8-5(7)4(3)6/h6H,2H2,1H3 |
InChI Key: | WXXOVRUZZHZUNY-UHFFFAOYSA-N |
Melting Point: | 86 - 88°C |
Solubility: | DMSO, Methanol (Slightly) |
Appearance: | White to Off-White Solid |
Storage: | Hygroscopic, -20°C Freezer, Under inert atmosphere |
Complexity: | 157 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 114.031694049 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 114.031694049 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.5Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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