| CAS Number | 1344812-11-8 |
| Catalog Number | AG01A0D4(AGN-PC-0WODM5) |
| Chemical Name | sodium (1-oxo-2,3-dihydro-1H-inden-2-ylidene)methanolate |
| IUPAC Name | sodium;(3-oxo-1H-inden-2-ylidene)methanolate |
| InChI | InChI=1S/C10H8O2.Na/c11-6-8-5-7-3-1-2-4-9(7)10(8)12;/h1-4,6,11H,5H2;/q;+1/p-1 |
| InChI Key | WIBQGNOSLLZCQA-UHFFFAOYSA-M |
| MDL Number | MFCD22378688 |
| Molecular Formula | C10H7NaO2 |
| Molecular Weight | 182.1512 |
| SMILES | [Na+].[O-]C=C1C(=O)C2=C(C=CC=C2)C1 |
| Synonyms | 1344812-11-8,
sodium (1-oxo-2,3-dihydro-1H-inden-2-ylidene)methanolate,
AKOS017382597,
NE20857,
|
| Complexity | 235 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 182.034g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 182.154g/mol |
| Monoisotopic Mass | 182.034g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 40.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
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Certificate of Analysis
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