(R)-2,2'-Dihydroxy-[1,1'-binaphthalene]-3,3'-dicarboxaldehyde - ≥97% , CAS No.121314-69-0

CAS: 121314-69-0 Cat. No.: R299808 Molecular Weight: 342.34 EC Number: 858-943-6

GRADE & PURITY ≥97%

Synonyms

(R)-3,3'-Diformyl-2,2'-dihydroxy-1,1'-binaphthyl | (R)-3,3'-Diformyl-2,2'-dihydroxy-1,1'-binaphthyl | R-2,2'-dihydroxy-[1,1'-Binaphthalene]-3,3'-dicarboxaldehyde | (R)-2,2''-Dihydroxy-[1,1''-binaphthalene]-3,3''-dicarboxaldehyde | (S)-2,2'-dihydroxy-[1,1'

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

(R)-3, 3'-Diformyl-2, 2'-dihydroxy-1, 1'-binaphthyl | (R)-3, 3'-Diformyl-2, 2'-dihydroxy-1, 1'-binaphthyl | R-2, 2'-dihydroxy-[1, 1'-Binaphthalene]-3, 3'-dicarboxaldehyde | (R)-2, 2''-Dihydroxy-[1, 1''-binaphthalene]-3, 3''-dicarboxaldehyde | (S)-2, 2'-dihydroxy-[1, 1'

Specifications & Purity

≥97%

Storage

Store at 2-8°C, Protected from light, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Canonical Smiles: C1=CC=C2C(=C1)C=C(C(=C2C3=C(C(=CC4=CC=CC=C43)C=O)O)O)C=O
• IUPAC Name: 4-(3-formyl-2-hydroxynaphthalen-1-yl)-3-hydroxynaphthalene-2-carbaldehyde
• InChIKey: DENRDANQMQOFEU-UHFFFAOYSA-N
• INCHI: 1S/C22H14O4/c23-11-15-9-13-5-1-3-7-17(13)19(21(15)25)20-18-8-4-2-6-14(18)10-16(12-24)22(20)26/h1-12,25-26H
• Isomeric SMILES: C1=CC=C2C(=C1)C=C(C(=C2C3=C(C(=CC4=CC=CC=C43)C=O)O)O)C=O
• Molecular Weight: 342.34

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Naphthalenes
• Subclass: Naphthols and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthols and derivatives
• Alternative Parents: Phenols Aryl-aldehydes Vinylogous acids Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: 2-naphthol - Aryl-aldehyde - Phenol - Vinylogous acid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Aromatic homopolycyclic compound
• Description: 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

Chemical and Physical Properties

• Melt Point(°C): 285°C
• Molecular Weight: 342.300 g/mol
• XLogP3: 5.400
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 342.089 Da
• Monoisotopic Mass: 342.089 Da
• Topological Polar Surface Area: 74.600 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 474.000
• 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