| CAS Number | 1137967-28-2 |
| Catalog Number | AG01DZOD |
| Chemical Name | (Z)-FeCP-oxindole |
| IUPAC Name | cyclopenta-1,3-diene;3-(cyclopenta-2,4-dien-1-ylidenemethyl)-1H-indol-2-olate;iron(2+) |
| InChI | InChI=1S/C14H11NO.C5H5.Fe/c16-14-12(9-10-5-1-2-6-10)11-7-3-4-8-13(11)15-14;1-2-4-5-3-1;/h1-9,15-16H;1-5H;/q;-1;+2/p-1 |
| InChI Key | MTGBTDOTYGXLBK-UHFFFAOYSA-M |
| MDL Number | MFCD18252658 |
| Molecular Formula | C19H15FeNO |
| Molecular Weight | 329.1735 |
| SMILES | C(=C1C(NC2=CC=CC=C12)=O)[C-]12[CH]3=[CH]4[CH]5=[CH]1[Fe+2]16782345[CH]2=[CH]1[CH]6=[CH]7[CH-]82 |
| Synonyms | (E)-3-ferrocenylmethylidene-1,3-dihydro-2H-indol-2-one,
(Z)-3-ferrocenylmethylidene-1,3-dihydro-2H-indol-2-one,
3-ferrocenylmethylidene-1,3-dihydro-2H-indol-2-one,
(Z)-FeCP-oxindole,
1137967-28-2,
(E)-3-Ferrocenylmethylidene-1,3-dihydro-2H-indol-2-one,
AKOS024457847,
AKOS024457848,
(Z)-3-Ferrocenylmethylidene-1,3-dihydro-2H-indol-2-one,
(E)-FeCp-oxindole,
884338-18-5,
|
| Complexity | 353 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 3 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 329.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 329.18g/mol |
| Monoisotopic Mass | 329.05g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 38.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number