3-benzamidobenzoic acid
3-benzamidobenzoic acid structure
|
Common Name | 3-benzamidobenzoic acid | ||
|---|---|---|---|---|
| CAS Number | 587-54-2 | Molecular Weight | 241.24200 | |
| Density | 1.334g/cm3 | Boiling Point | 353.5ºC at 760 mmHg | |
| Molecular Formula | C14H11NO3 | Melting Point | 252.5°C | |
| MSDS | N/A | Flash Point | 167.6ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 3-benzamidobenzoic 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 | 1.334g/cm3 |
|---|---|
| Boiling Point | 353.5ºC at 760 mmHg |
| Melting Point | 252.5°C |
| Molecular Formula | C14H11NO3 |
| Molecular Weight | 241.24200 |
| Flash Point | 167.6ºC |
| Exact Mass | 241.07400 |
| PSA | 66.40000 |
| LogP | 2.71010 |
| Index of Refraction | 1.672 |
| InChIKey | WXTOAZQBWHSIQN-UHFFFAOYSA-N |
| SMILES | O=C(O)c1cccc(NC(=O)c2ccccc2)c1 |
| Storage condition | 2-8°C |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2924299090 |
|---|
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 9 | |
|---|---|
| DownStream 2 | |
CAS#:39799-70-7
CAS#:98-88-4
CAS#:99-05-8
CAS#:582-77-4
CAS#:4518-10-9
CAS#:55-21-0
CAS#:93-98-1
CAS#:614-28-8
CAS#:110-86-1
CAS#:76712-94-2
CAS#:917513-98-5This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2924299090 |
|---|---|
| Summary | 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table contains target information, in‑vitro & in‑vivo assay data for this compound.
|
Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
|
|
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
|
|
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
|
|
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1100
|
|
Name: qHTS for Inhibitors of human tyrosyl-DNA phosphodiesterase 1 (TDP1): qHTS in cells in...
Source: NCGC
Target: TDP1 protein [Homo sapiens]
External Id: TDP1101
|
|
Name: Schnurri-3 Inhibitors: specific inducers of adult bone formation Measured in Cell-Bas...
Source: Broad Institute
Target: N/A
External Id: 2134-01_Inhibitor_SinglePoint_HTS_Activity_Set2
|
|
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
|
|
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
|
|
Name: High throughput screen for small molecule inhibitors of a hypoxia-regulated fluoresce...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: N/A
External Id: HMS1149-MLP
|
|
Name: qHTS for Inhibitors of AMA1-RON; Towards Development of Antimalarial Drug Lead: Prima...
Source: NCGC
Target: apical membrane antigen 1, AMA1 [Plasmodium falciparum 3D7]
External Id: AMA1100
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 3-benzoylamino-benzoic acid |
| 3-Benzamino-benzoesaeure |
| 3-Benzoylamino-benzoesaeure |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the upstream materials of 3-benzamidobenzoic acid? |
| A: Related upstream materials(CAS) of 3-benzamidobenzoic acid: 39799-70-7;98-88-4;99-05-8;582-77-4;4518-10-9;55-21-0;93-98-1;614-28-8;110-86-1. |
| Q: What is the LogP of 3-benzamidobenzoic acid? |
| A: LogP of 3-benzamidobenzoic acid is 2.71010. |
| Q: What is the molecular formula of 3-benzamidobenzoic acid? |
| A: Molecular formula of 3-benzamidobenzoic acid is C14H11NO3. |
| Q: What English synonyms does 3-benzamidobenzoic acid have? |
| A: English synonyms of 3-benzamidobenzoic acid: 3-benzoylamino-benzoic acid, 3-Benzamino-benzoesaeure, 3-Benzoylamino-benzoesaeure. |
| Q: What is the English name of 3-benzamidobenzoic acid? |
| A: The English name of 3-benzamidobenzoic acid is 3-benzamidobenzoic acid. |
| Q: What are the storage conditions for 3-benzamidobenzoic acid? |
| A: Storage conditions for 3-benzamidobenzoic acid: 2-8°C. |
| Q: What is the InChIKey of 3-benzamidobenzoic acid? |
| A: InChIKey of 3-benzamidobenzoic acid is WXTOAZQBWHSIQN-UHFFFAOYSA-N. |
| Q: What is the melting point of 3-benzamidobenzoic acid? |
| A: Melting point of 3-benzamidobenzoic acid is 252.5°C. |
| Q: What is the polar surface area (PSA) of 3-benzamidobenzoic acid? |
| A: Polar surface area (PSA) of 3-benzamidobenzoic acid is 66.40000. |
| Q: What are the downstream products of 3-benzamidobenzoic acid? |
| A: Related downstream products(CAS) of 3-benzamidobenzoic acid: 76712-94-2;917513-98-5. |
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. |