| CAS Number | 4081-00-9 |
| Catalog Number | AG00IMKG(AGN-PC-0KPBV1) |
| Chemical Name | Spiro[9H-fluorene-9,9'-[9H]xanthene]-3',6'-diol |
| IUPAC Name | spiro[fluorene-9,9'-xanthene]-3',6'-diol |
| InChI | InChI=1S/C25H16O3/c26-15-9-11-21-23(13-15)28-24-14-16(27)10-12-22(24)25(21)19-7-3-1-5-17(19)18-6-2-4-8-20(18)25/h1-14,26-27H |
| InChI Key | ZTQUBBFVYUHQRC-UHFFFAOYSA-N |
| MDL Number | MFCD01077103 |
| Molecular Formula | C25H16O3 |
| Molecular Weight | 364.3927 |
| SMILES | OC1=CC(OC2=C3C=CC(O)=C2)=C(C43C5=C(C6=C4C=CC=C6)C=CC=C5)C=C1 |
| Synonyms | spiro[fluorene-9,9'-xanthene]-3',6'-diol,
4081-00-9,
Spiro[9H-fluorene-9,9'-[9H]xanthene]-3',6'-diol,
AC1MJ5FI,
SCHEMBL8984634,
CTK1D4264,
DTXSID30389294,
ZINC4713071,
AKOS000578976,
BAS 00433016,
S0953,
Spiro[9H-xanthene-9,9'-[9H]fluorene]-3,6-diol,
ZINC04713071,
CID3106818,
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| Complexity | 540 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 364.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 28 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 364.4g/mol |
| Monoisotopic Mass | 364.11g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number