| CAS Number | 1345980-40-6 |
| Catalog Number | AG01ENEU(AGN-PC-3H45KD) |
| Chemical Name | FLUO-8 (AM) |
| IUPAC Name | acetyloxymethyl 2-[N-[2-(acetyloxymethoxy)-2-oxoethyl]-4-[3-(acetyloxymethoxy)-6-oxoxanthen-9-yl]-2-[2-[2-[bis[2-(acetyloxymethoxy)-2-oxoethyl]amino]phenoxy]ethoxy]anilino]acetate |
| InChI | InChI=1S/C50H50N2O23/c1-30(53)65-25-70-37-12-14-39-44(20-37)75-43-19-36(58)11-13-38(43)50(39)35-10-15-41(52(23-48(61)73-28-68-33(4)56)24-49(62)74-29-69-34(5)57)45(18-35)64-17-16-63-42-9-7-6-8-40(42)51(21-46(59)71-26-66-31(2)54)22-47(60)72-27-67-32(3)55/h6-15,18-20H,16-17,21-29H2,1-5H3 |
| InChI Key | BKYHTWFRZPRHNM-UHFFFAOYSA-N |
| MDL Number | MFCD27977558 |
| Molecular Formula | C50H50N2O23 |
| Molecular Weight | 1046.9316 |
| SMILES | CC(=O)OCOC(=O)CN(CC(=O)OCOC(=O)C)c1ccccc1OCCOc2cc(ccc2N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)C3=C4C=CC(=O)C=C4Oc5cc(OCOC(=O)C)ccc35 |
| Synonyms | fluo-8 AM,
Fluo-8 AM,
SCHEMBL828166,
J3.565.189F,
1345980-40-6,
|
| Complexity | 2090 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 1046.28g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 75 |
| Hydrogen Bond Acceptor Count | 25 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 1046.941g/mol |
| Monoisotopic Mass | 1046.28g/mol |
| Rotatable Bond Count | 36 |
| Topological Polar Surface Area | 297A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number