Sunset Yellow FCF - ≥87% , CAS No.2783-94-0

CAS: 2783-94-0 Cat. No.: S109563 분자식: C₁₆H₁₀N₂Na₂O₇S₂ 분자량: 452.37 EC 번호: 220-491-7 PubChem CID: 17730

GRADE & PURITY ≥87%

Synonyms

Acid Food Yellow 3 | Alabaster No. 3 | Hispamin Yellow F | L. Orange Z2010 | Orange II R | Yellow EMBL | Eurocert Orange FCF | Hexacol Sunset Yellow FCF | Orange Yellow S.fq | Sunlight Yellow FCF | Sunset Yellow FU Supra | Direct Yellow K | Dye Sunset Yel

Storage

Room temperature

Shipped In

Normal

Specifications

동의어

Acid Food Yellow 3 | Alabaster No. 3 | Hispamin Yellow F | L. Orange Z2010 | Orange II R | Yellow EMBL | Eurocert Orange FCF | Hexacol Sunset Yellow FCF | Orange Yellow S.fq | Sunlight Yellow FCF | Sunset Yellow FU Supra | Direct Yellow K | Dye Sunset Yel

사양 및 순도

≥87%

보관 조건

Room temperature

배송

Normal

순수함

≥87%

이름과 식별자

Pubchem Sid

488182408

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488182408

정식 스마일

C1=CC(=CC=C1N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+]

IUPAC Name

disodium;6-hydroxy-5-[(4-sulfonatophenyl)diazenyl]naphthalene-2-sulfonate

InChIKey

OIQPTROHQCGFEF-UHFFFAOYSA-L

INCHI

1S/C16H12N2O7S2.2Na/c19-15-8-1-10-9-13(27(23,24)25)6-7-14(10)16(15)18-17-11-2-4-12(5-3-11)26(20,21)22;;/h1-9,19H,(H,20,21,22)(H,23,24,25);;/q;2*+1/p-2

이성체 SMILES

C1=CC(=CC=C1N=NC2=C(C=CC3=C2C=CC(=C3)S(=O)(=O)[O-])O)S(=O)(=O)[O-].[Na+].[Na+]

WGK 독일

2

RTECS

QK2450000

PubChem CID

17730

분자량

452.37

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Naphthalenes
      • Subclass Naphthalene sulfonic acids and derivatives
        • Level5 Naphthalene sulfonates
          • Level6 2-naphthalene sulfonates

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Naphthalenes
• Subclass: Naphthalene sulfonic acids and derivatives
• Intermediate Tree Nodes: Naphthalene sulfonates
• Direct Parent: 2-naphthalene sulfonates
• Alternative Parents: 2-naphthalene sulfonic acids and derivatives Benzenesulfonic acids and derivatives Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Phenoxides Sulfonyls Organosulfonic acids Azo compounds Propargyl-type 1,3-dipolar organic compounds Organooxygen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: 2-naphthalene sulfonate - 2-naphthalene sulfonic acid or derivatives - Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Phenoxide - Monocyclic benzene moiety - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Azo compound - Organic alkali metal salt - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic cation - Aromatic homopolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as 2-naphthalene sulfonates. These are organic aromatic compounds that contain a naphthalene moiety that carries a sulfonic acid group at the 2-position. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
• 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

관련 대상(인간)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

작용 메커니즘

화학 및 물리적 특성

• 용해성: Soluble in water; Degree of Solubility in water: 190 g/l; Very slightly soluble in Ethanol
• 녹는점(°C): 390°C
• 분자량: 452.400 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 2
• Exact Mass: 451.972 Da
• Monoisotopic Mass: 451.972 Da
• Topological Polar Surface Area: 176.000 Ų
• Heavy Atom Count: 29
• Formal Charge: 0
• Complexity: 722.000
• 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: 3

XLogP3