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· · COA & SDS 모든 제품에 대한 사용 가능 · 주식 상품에 대한 같은 날 배송 바탈라닙 석시네이트 - ≥99%(HPLC) , CAS No.212142-18-2
Synonyms
1-(4-클로로아닐리노)-4-(4-피리딜메틸)프탈라진숙신산염 | PTK 787/ZK 222584 | 1-프탈라지아민, N-(4-클로로페닐)-4-(4피리디닐메틸)-, 부탄에디오에이트(1:1) | CCRIS 4288 | 바탈라닙숙신산염 | CGP-79787D | NSC-77381 | PTK787/ZK222584 | PTK-787/ZK-
Shipped In
아이스 박스 + 아이스 패드
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Why this grade ≥99%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping 20°C에서 보관 Ships 아이스 박스 + 아이스 패드 Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications 동의어
1-(4-클로로아닐리노)-4-(4-피리딜메틸)프탈라진숙신산염 | PTK 787/ZK 222584 | 1-프탈라지아민, N-(4-클로로페닐)-4-(4피리디닐메틸)-, 부탄에디오에이트(1:1) | CCRIS 4288 | 바탈라닙숙신산염 | CGP-79787D | NSC-77381 | PTK787/ZK222584 | PTK-787/ZK-
이름과 식별자 Pubchem Sid 504757353 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/504757353 정식 스마일 C1=CC=C2C(=C1)C(=NN=C2NC3=CC=C(C=C3)Cl)CC4=CC=NC=C4.C(CC(=O)O)C(=O)O IUPAC Name butanedioic acid;N-(4-chlorophenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine InChIKey LLDWLPRYLVPDTG-UHFFFAOYSA-N INCHI 1S/C20H15ClN4.C4H6O4/c21-15-5-7-16(8-6-15)23-20-18-4-2-1-3-17(18)19(24-25-20)13-14-9-11-22-12-10-14;5-3(6)1-2-4(7)8/h1-12H,13H2,(H,23,25);1-2H2,(H,5,6)(H,7,8) 이성체 SMILES C1=CC=C2C(=C1)C(=NN=C2NC3=CC=C(C=C3)Cl)CC4=CC=NC=C4.C(CC(=O)O)C(=O)O PubChem CID 151193 분자량 464.90
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds 분류 Diazanaphthalenes Subclass Benzodiazines Intermediate Tree Nodes Not available Direct Parent Phthalazines Alternative Parents Aniline and substituted anilines Chlorobenzenes Aminopyridazines Pyridines and derivatives Imidolactams Dicarboxylic acids and derivatives Aryl chlorides Heteroaromatic compounds Secondary amines Azacyclic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives Molecular Framework Not available Substituents Phthalazine - Aniline or substituted anilines - Aminopyridazine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Pyridazine - Pyridine - Benzenoid - Imidolactam - Heteroaromatic compound - Azacycle - Secondary amine - Organochloride - Organohalogen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Amine - Aromatic heteropolycyclic compound 설명 This compound belongs to the class of organic compounds known as phthalazines. These are compounds containing a phthalazine moiety, which consists of a benzene ring fused to a pyridazine, forming a 2,3-benzodiazine skeleton. External Descriptors Not available Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D 구조 관련 대상(인간) 관련 대상(비인간) 작용 메커니즘 인증서(CoA, COO, BSE/TSE 및 분석 차트) 화학 및 물리적 특성 용해성 Solvent:DMSO, Max Conc. mg/mL: 46.49, Max Conc. mM: 100 분자량 464.900 g/mol XLogP3 Hydrogen Bond Donor Count 3 Hydrogen Bond Acceptor Count 8 Rotatable Bond Count 7 Exact Mass 464.125 Da Monoisotopic Mass 464.125 Da Topological Polar Surface Area 125.000 Ų Heavy Atom Count 33 Formal Charge 0 Complexity 499.000 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 2
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