8-Nitro-1-naphthalenecarboxylic acid
8-Nitro-1-naphthalenecarboxylic acid structure
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Common Name | 8-Nitro-1-naphthalenecarboxylic acid | ||
|---|---|---|---|---|
| CAS Number | 2216-13-9 | Molecular Weight | 217.17800 | |
| Density | 1.468g/cm3 | Boiling Point | 449.3ºC at 760mmHg | |
| Molecular Formula | C11H7NO4 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 199.2ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 8-nitronaphthalene-1-carboxylic acid |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.468g/cm3 |
|---|---|
| Boiling Point | 449.3ºC at 760mmHg |
| Molecular Formula | C11H7NO4 |
| Molecular Weight | 217.17800 |
| Flash Point | 199.2ºC |
| Exact Mass | 217.03800 |
| PSA | 83.12000 |
| LogP | 2.96940 |
| Vapour Pressure | 7.4E-09mmHg at 25°C |
| Index of Refraction | 1.706 |
| InChIKey | USMKVLABRYGBJX-UHFFFAOYSA-N |
| SMILES | O=C(O)c1cccc2cccc([N+](=O)[O-])c12 |
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATAMUTATION DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2916399090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 8 | |
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| DownStream 7 | |
CAS#:86-55-5
CAS#:42758-56-5
CAS#:5903-23-1
CAS#:64-19-7
CAS#:2459-24-7
CAS#:7664-93-9
CAS#:7697-37-2
CAS#:67-64-1
CAS#:602-38-0
CAS#:130-00-7
CAS#:129-02-2
CAS#:1729-99-3
CAS#:2364-46-7
CAS#:4537-00-2![1-acetylbenzo[cd]indol-2-one structure](https://image.chemsrc.com/caspic/461/58779-65-0.png)
CAS#:58779-65-0This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2916399090 |
|---|---|
| Summary | 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
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Name: Drug conversion assessed as formation of oxazole derivatives in presence of Zn/HOAc
Source: ChEMBL
Target: N/A
External Id: CHEMBL2072470
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Name: Mutagenicity in Salmonella typhimurium TA100
Source: ChEMBL
Target: Salmonella enterica subsp. enterica serovar Typhimurium
External Id: CHEMBL2072469
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 8-Nitro-1-naphthoic acid |
| 8-nitro-1-naphthalenecarboxylic acid |
| 8-nitro-naphthalene-1-carboxylic acid |
| 1-Naphthalenecarboxylic acid,8-nitro |
| 1-Naphthoic acid,8-nitro |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 8-nitronaphthalene-1-carboxylic acid? |
| A: InChIKey of 8-nitronaphthalene-1-carboxylic acid is USMKVLABRYGBJX-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 8-nitronaphthalene-1-carboxylic acid? |
| A: SMILES notation of 8-nitronaphthalene-1-carboxylic acid is O=C(O)c1cccc2cccc([N+](=O)[O-])c12. |
| Q: What is the molecular formula of 8-nitronaphthalene-1-carboxylic acid? |
| A: Molecular formula of 8-nitronaphthalene-1-carboxylic acid is C11H7NO4. |
| Q: What is the CAS number of 8-nitronaphthalene-1-carboxylic acid? |
| A: CAS number of 8-nitronaphthalene-1-carboxylic acid is 2216-13-9. |
| Q: What is the English name of 8-nitronaphthalene-1-carboxylic acid? |
| A: The English name of 8-nitronaphthalene-1-carboxylic acid is 8-nitronaphthalene-1-carboxylic acid. |
| Q: What are the upstream materials of 8-nitronaphthalene-1-carboxylic acid? |
| A: Related upstream materials(CAS) of 8-nitronaphthalene-1-carboxylic acid: 86-55-5;42758-56-5;5903-23-1;64-19-7;2459-24-7;7664-93-9;7697-37-2;67-64-1. |
| Q: What is the molecular weight of 8-nitronaphthalene-1-carboxylic acid? |
| A: Molecular weight of 8-nitronaphthalene-1-carboxylic acid is 217.17800. |
| Q: What is the polar surface area (PSA) of 8-nitronaphthalene-1-carboxylic acid? |
| A: Polar surface area (PSA) of 8-nitronaphthalene-1-carboxylic acid is 83.12000. |
| Q: What are the downstream products of 8-nitronaphthalene-1-carboxylic acid? |
| A: Related downstream products(CAS) of 8-nitronaphthalene-1-carboxylic acid: 602-38-0;130-00-7;129-02-2;1729-99-3;2364-46-7;4537-00-2;58779-65-0. |
| Q: What is the boiling point of 8-nitronaphthalene-1-carboxylic acid? |
| A: Boiling point of 8-nitronaphthalene-1-carboxylic acid is 449.3ºC at 760mmHg. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |