Determine the necessary mass, volume, or concentration for preparing a solution.
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analytical standard 분석 표준물질 for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 15 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| ALogP | 2.8 |
|---|
| Pubchem Sid | 504750739 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504750739 |
| 정식 스마일 | COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3 |
| IUPAC Name | methyl N-(6-benzoyl-1H-benzimidazol-2-yl)carbamate |
| InChIKey | OPXLLQIJSORQAM-UHFFFAOYSA-N |
| INCHI | 1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21) |
| 이성체 SMILES | COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3 |
| RTECS | EY8600000 |
| 분자량 | 295.29 |
| Reaxy-Rn | 688513 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=688513&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| 분류 | Benzene and substituted derivatives |
| Subclass | Benzophenones |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Benzophenones |
| Alternative Parents | 2-benzimidazolylcarbamic acid esters Aryl-phenylketones Benzoyl derivatives Imidazoles Heteroaromatic compounds Carbamate esters Organic carbonic acids and derivatives Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | 2-benzimidazolylcarbamic acid ester - Benzophenone - Aryl-phenylketone - Benzimidazole - Benzoyl - Aryl ketone - Azole - Imidazole - Heteroaromatic compound - Carbamic acid ester - Ketone - Carbonic acid derivative - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound |
| 설명 | This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups. |
| External Descriptors | carbamate ester - aromatic ketone - benzimidazoles |
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Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | 날짜 | 항목 |
|---|---|---|---|
| Certificate of Analysis | Apr 07, 2025 | M111946 | |
| Certificate of Analysis | Apr 07, 2025 | M111946 | |
| Certificate of Analysis | Apr 07, 2025 | M111946 | |
| Certificate of Analysis | Oct 16, 2024 | M111946 | |
| Certificate of Analysis | Sep 13, 2024 | M111946 | |
| Certificate of Analysis | Sep 13, 2024 | M111946 | |
| Certificate of Analysis | Sep 13, 2024 | M111946 |
| 녹는점(°C) | 288.5°C |
|---|---|
| 분자량 | 295.290 g/mol |
| XLogP3 | 2.800 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 295.096 Da |
| Monoisotopic Mass | 295.096 Da |
| Topological Polar Surface Area | 84.100 Ų |
| Heavy Atom Count | 22 |
| Formal Charge | 0 |
| Complexity | 423.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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