AC1LNRQM
3-[5-[(2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-ylidene)methyl]furan-2-yl]-4-methylbenzoic acid
Also Known As: AM-879/15039166|3-{5-[(2,4-dioxo-1,5-dioxaspiro[5.5]undec-3-ylidene)methyl]-2-furyl}-4-methylbenzoic acid|3-(5-((2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-ylidene)methyl)furan-2-yl)-4-methylbenzoic acid|3-[5-[(2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-ylidene)methyl]furan-2-yl]-4-methylbenzoic acid|3-[5-({2,4-DIOXO-1,5-DIOXASPIRO[5.5]UNDECAN-3-YLIDENE}METHYL)FURAN-2-YL]-4-METHYLBENZOIC ACID|3-[5-[(8,10-dioxo-7,11-dioxaspiro[5.5]undecan-9-ylidene)methyl]furan-2-yl]-4-methylbenzoic acid|3-{5-[(2,4-dioxo-1,5-dioxaspiro[5.5]undec-3-ylidene)methyl]furan-2-yl}-4-methylbenzoic acid
| Molecular Formula | C22H20O7 |
|---|---|
| Molecular Weight | 396.1209 g/mol |
| LogP | 4.09702 |
| Topological Polar Surface Area | 103.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 396.1209 |
| Monoisotopic Mass | 396.1209 |
| Heavy Atoms | 29 |
| Complexity | 999.5318 |
Chemical Identifiers
| CAS Number | 445405-10-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)O)C2=CC=C(O2)C=C3C(=O)OC4(CCCCC4)OC3=O |
Product Overview
AC1LNRQM (CAS 445405-10-7), with molecular formula C22H20O7 and molecular weight 396.1209 g/mol. IUPAC: 3-[5-[(2,4-dioxo-1,5-dioxaspiro[5.5]undecan-3-ylidene)methyl]furan-2-yl]-4-methylbenzoic acid.
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