Benzoic acid,2-[[(3-methylphenyl)amino]carbonyl]
![Benzoic acid,2-[[(3-methylphenyl)amino]carbonyl] Structure](https://image.chemsrc.com/caspic/033/85-72-3.png)
Benzoic acid,2-[[(3-methylphenyl)amino]carbonyl] structure
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Common Name | Benzoic acid,2-[[(3-methylphenyl)amino]carbonyl] | ||
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| CAS Number | 85-72-3 | Molecular Weight | 255.26900 | |
| Density | 1.295g/cm3 | Boiling Point | 371ºC at 760 mmHg | |
| Molecular Formula | C15H13NO3 | Melting Point | 150ºC | |
| MSDS | N/A | Flash Point | 178.2ºC | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-[(3-methylphenyl)carbamoyl]benzoic 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 | 1.295g/cm3 |
|---|---|
| Boiling Point | 371ºC at 760 mmHg |
| Melting Point | 150ºC |
| Molecular Formula | C15H13NO3 |
| Molecular Weight | 255.26900 |
| Flash Point | 178.2ºC |
| Exact Mass | 255.09000 |
| PSA | 66.40000 |
| LogP | 3.01850 |
| Index of Refraction | 1.657 |
| InChIKey | AZPJXONNBLOZFE-UHFFFAOYSA-N |
| SMILES | Cc1cccc(NC(=O)c2ccccc2C(=O)O)c1 |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2924299090 |
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This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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Benzoic acid,2-... CAS#:85-72-3 |
| Literature: Journal of the American Chemical Society, , p. 1887 |
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Benzoic acid,2-... CAS#:85-72-3 |
| Literature: Journal of the American Chemical Society, , p. 1887 |
This 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.
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Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS
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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
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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
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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
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Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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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
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Name: Fluorescence-based cell-based primary high throughput screening assay to identify pos...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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Name: Fluorescence polarization-based biochemical high throughput primary assay to identify...
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id: SIAE_INH_FP_1536_1X%INH PRUN
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This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| N-m-tolyl-phthalamic acid |
| 3'-Methylphthalanilic acid |
| Duraset 20W |
| N-m-Tolyl-phthalamidsaeure |
| EINECS 201-626-9 |
| Phthalsaeure-mono-m-toluidid |
| Tomaset |
| Phthalanilic acid,3'-methyl |
| N-M-T |
| N-m-Tolylphthalaminic acid |
| DURASET |
| N-meta-tolyl phthalamic acid |
| phthalamate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 2-[(3-methylphenyl)carbamoyl]benzoic acid? |
| A: Polar surface area (PSA) of 2-[(3-methylphenyl)carbamoyl]benzoic acid is 66.40000. |
| Q: What is the LogP of 2-[(3-methylphenyl)carbamoyl]benzoic acid? |
| A: LogP of 2-[(3-methylphenyl)carbamoyl]benzoic acid is 3.01850. |
| Q: What is the CAS number of 2-[(3-methylphenyl)carbamoyl]benzoic acid? |
| A: CAS number of 2-[(3-methylphenyl)carbamoyl]benzoic acid is 85-72-3. |
| Q: What is the SMILES notation of 2-[(3-methylphenyl)carbamoyl]benzoic acid? |
| A: SMILES notation of 2-[(3-methylphenyl)carbamoyl]benzoic acid is Cc1cccc(NC(=O)c2ccccc2C(=O)O)c1. |
| Q: What is the InChIKey of 2-[(3-methylphenyl)carbamoyl]benzoic acid? |
| A: InChIKey of 2-[(3-methylphenyl)carbamoyl]benzoic acid is AZPJXONNBLOZFE-UHFFFAOYSA-N. |
| Q: What English synonyms does 2-[(3-methylphenyl)carbamoyl]benzoic acid have? |
| A: English synonyms of 2-[(3-methylphenyl)carbamoyl]benzoic acid: N-m-tolyl-phthalamic acid, 3'-Methylphthalanilic acid, Duraset 20W, N-m-Tolyl-phthalamidsaeure, EINECS 201-626-9, Phthalsaeure-mono-m-toluidid, Tomaset, Phthalanilic acid,3'-methyl, N-M-T, N-m-Tolylphthalaminic acid, DURASET, N-meta-tolyl phthalamic acid, phthalamate. |
| Q: What is the melting point of 2-[(3-methylphenyl)carbamoyl]benzoic acid? |
| A: Melting point of 2-[(3-methylphenyl)carbamoyl]benzoic acid is 150ºC. |
| Q: What is the boiling point of 2-[(3-methylphenyl)carbamoyl]benzoic acid? |
| A: Boiling point of 2-[(3-methylphenyl)carbamoyl]benzoic acid is 371ºC at 760 mmHg. |
| Q: What is the molecular formula of 2-[(3-methylphenyl)carbamoyl]benzoic acid? |
| A: Molecular formula of 2-[(3-methylphenyl)carbamoyl]benzoic acid is C15H13NO3. |
| Q: What is the English name of 2-[(3-methylphenyl)carbamoyl]benzoic acid? |
| A: The English name of 2-[(3-methylphenyl)carbamoyl]benzoic acid is 2-[(3-methylphenyl)carbamoyl]benzoic acid. |
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. |