Compound C19H12O3S
2-(7-oxobenzo[a]phenalen-3-yl)sulfanylacetic acid
CAS: 69658-13-5
| Molecular Formula | C19H12O3S |
|---|---|
| Molecular Weight | 320.4 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 79.7 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.05072 |
| Heavy Atoms | 23 |
| Complexity | 491.0 |
Chemical Identifiers
| CAS Number | 69658-13-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C3=C4C(=C(C=C3)SCC(=O)O)C=CC=C4C2=O |
| InChIKey | QQRGUQLAJOQLIW-UHFFFAOYSA-N |
📖 Product Overview
Compound C19H12O3S (CAS: 69658-13-5) is a chemical compound with molecular formula C19H12O3S and molecular weight 320.4 g/mol. Its IUPAC systematic name is 2-(7-oxobenzo[a]phenalen-3-yl)sulfanylacetic acid.
QQRGUQLAJOQLIW-UHFFFAOYSA-N.
SMILES: C1=CC=C2C(=C1)C3=C4C(=C(C=C3)SCC(=O)O)C=CC=C4C2=O.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Frequently Asked Questions
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📚 Academic Support
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