| CAS Number | 101327-87-1 |
| Catalog Number | AG00048L(AGN-PC-00FSON) |
| Chemical Name | 7-Quinolinecarboxaldehyde, 8-nitro- |
| IUPAC Name | 8-nitroquinoline-7-carbaldehyde |
| InChI | InChI=1S/C10H6N2O3/c13-6-8-4-3-7-2-1-5-11-9(7)10(8)12(14)15/h1-6H |
| InChI Key | CGYVBVWBGRTQJQ-UHFFFAOYSA-N |
| MDL Number | MFCD08436438 |
| Molecular Formula | C10H6N2O3 |
| Molecular Weight | 202.1662 |
| SMILES | [N+](=O)([O-])C=1C(=CC=C2C=CC=NC12)C=O |
| Synonyms | 8-Nitro-7-quinolinecarboxaldehyde,
101327-87-1,
8-nitroquinoline-7-carbaldehyde,
8-Nitroquinoline-7-carboxaldehyde,
7-Formyl-8-nitroquinoline,
ACMC-2097uw,
SCHEMBL1011709,
8-Nitro-7-quinolinecarbaldehyde,
CTK3J9690,
8-Nitro-quinoline-7-carbaldehyde,
DTXSID70472154,
CGYVBVWBGRTQJQ-UHFFFAOYSA-N,
ZX-AL000224,
ANW-14454,
MFCD08436438,
ZINC26438466,
AKOS000319912,
TR-033807,
BB 0262709,
N0852,
CID11769554,
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| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.038g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.169g/mol |
| Monoisotopic Mass | 202.038g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 75.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H315-H319-H341
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Packing Group
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Precautionary statements
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P501-P202-P201-P264-P280-P308+P313-P337+P313-P305+P351+P338-P302+P352-P332+P313-P362-P405
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UN Code
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Certificate of Analysis
Lot Number