Acetic acid, 2,2'-[(4-methyl-2-oxo-2H-1-benzopyran-5,7-diyl)bis(oxy)]bis-
Basic information
- CAS
38035-11-9- Standard SMILES
Cc1cc(=O)oc2cc(OCC(=O)O)cc(OCC(=O)O)c12- InChIKey
KHIRWZSABYLNKT-UHFFFAOYSA-N- Molecular formula
- C14H12O8
- Average molar mass
- 308.24 g/mol
- Monoisotopic mass
- 308.05321734
Names & identifiers
- Preferred name
- Acetic acid, 2,2'-[(4-methyl-2-oxo-2H-1-benzopyran-5,7-diyl)bis(oxy)]bis-
- IUPAC
- 2-[5-(carboxymethoxy)-4-methyl-2-oxochromen-7-yl]oxyacetic acid
Names & synonyms
38035-11-9Acetic acid, 2,2'-[(4-methyl-2-oxo-2H-1-benzopyran-5,7-diyl)bis(oxy)]bis-2,2'-((4-Methyl-2-oxo-2H-chromene-5,7-diyl)bis(oxy))diacetic acid2,2'-[(4-methyl-2-oxo-2H-chromene-5,7-diyl)bis(oxy)]diacetic acidOprea1_784109DTXSID801146857EiM07-30392STL464893AKOS003625668AF-399/095280542-[5-(carboxymethoxy)-4-methyl-2-oxochromen-7-yl]oxyacetic acid{[5-(carboxymethoxy)-4-methyl-2-oxo-2H-chromen-7-yl]oxy}acetic acid
Show more names
2,2'-[(4-Methyl-2-oxo-2H-1-benzopyran-5,7-diyl)bis(oxy)]diacetic acidAcetic acid, 2,2a(2)-[(4-methyl-2-oxo-2H-1-benzopyran-5,7-diyl)bis(oxy)]bis-
Database identifiers
- CAS
38035-11-9- PubChem CID
- 677583
- DTXSID
DTXSID801146857
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 497
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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