| CAS Number | 116668-56-5 |
| Catalog Number | AG000CY7(AGN-PC-0NZ29M) |
| Chemical Name | (S)-3-Phenyldihydrofuran-2,5-dione |
| IUPAC Name | (3S)-3-phenyloxolane-2,5-dione |
| InChI | InChI=1S/C10H8O3/c11-9-6-8(10(12)13-9)7-4-2-1-3-5-7/h1-5,8H,6H2/t8-/m0/s1 |
| InChI Key | HDFKMLFDDYWABF-QMMMGPOBSA-N |
| MDL Number | MFCD27922572 |
| Molecular Formula | C10H8O3 |
| Molecular Weight | 176.1687 |
| SMILES | O=C1C[C@H](C(=O)O1)C1=CC=CC=C1 |
| Synonyms | (S)-3-PHENYLDIHYDROFURAN-2,5-DIONE,
116668-56-5,
AC1LD5RS,
(S)-2-Phenylsuccinic anhydride,
(3S)-3-phenyloxolane-2,5-dione,
MFCD27922572,
ZINC100025341,
FCH2496234,
AS-42681,
AX8267101,
2,5-Furandione, dihydro-3-phenyl-, (3S)-,
Monophenyl succinic anhydride,
CID642780,
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| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 176.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 176.171g/mol |
| Monoisotopic Mass | 176.047g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number