Scarlet 808 - ≥98% , CAS No.3789-75-1

CAS: 3789-75-1 Cat. No.: S303602 분자식: C₂₃H₁₇N₃O₂ 분자량: 367.4 PubChem CID: 135409550

GRADE & PURITY ≥98%

Synonyms

3-HYDROXY-4-PHENYLAZO-NAPHTHALENE-2-CARBOXYLIC ACID PHENYLAMIDE | SCHEMBL2630605 | DTXSID30652379 | S9358 | SCARLET 808 | 3-hydroxy-N-phenyl-4-phenyldiazenylnaphthalene-2-carboxamide | AKOS037515502 | Bronze Red | SCARLET808 | FT-0775639 | 3-Oxo-N-phenyl-

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

동의어

3-HYDROXY-4-PHENYLAZO-NAPHTHALENE-2-CARBOXYLIC ACID PHENYLAMIDE | SCHEMBL2630605 | DTXSID30652379 | S9358 | SCARLET 808 | 3-hydroxy-N-phenyl-4-phenyldiazenylnaphthalene-2-carboxamide | AKOS037515502 | Bronze Red | SCARLET808 | FT-0775639 | 3-Oxo-N-phenyl-

사양 및 순도

≥98%

보관 조건

Protected from light,Store at -20°C

배송

Ice chest + Ice pads

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순수함

≥98%

이름과 식별자

• Pubchem Sid: 504773279
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504773279
• 정식 스마일: C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=C2O)N=NC4=CC=CC=C4
• IUPAC Name: 3-hydroxy-N-phenyl-4-phenyldiazenylnaphthalene-2-carboxamide
• InChIKey: WYUHTVDGHDRPDW-UHFFFAOYSA-N
• INCHI: 1S/C23H17N3O2/c27-22-20(23(28)24-17-10-3-1-4-11-17)15-16-9-7-8-14-19(16)21(22)26-25-18-12-5-2-6-13-18/h1-15,27H,(H,24,28)
• 이성체 SMILES: C1=CC=C(C=C1)NC(=O)C2=CC3=CC=CC=C3C(=C2O)N=NC4=CC=CC=C4
• PubChem CID: 135409550
• 분자량: 367.4

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Naphthalenes
      • Subclass Naphthols and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Naphthalenes
• Subclass: Naphthols and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthols and derivatives
• Alternative Parents: Benzene and substituted derivatives Azo compounds Propargyl-type 1,3-dipolar organic compounds Carboximidic acids Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: 2-naphthol - Monocyclic benzene moiety - Azo compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidic acid derivative - Carboximidic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic homopolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as naphthols and derivatives. These are naphthalene derivatives carrying one or more hydroxyl (-OH) groups at any ring position.
• 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.

DOI: 10.1186/s13321-016-0174-y

화학 및 물리적 특성

• 감도: Light sensitive
• 분자량: 367.400 g/mol
• XLogP3: 6.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 367.132 Da
• Monoisotopic Mass: 367.132 Da
• Topological Polar Surface Area: 74.100 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 540.000
• 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