(S)-2,2'-Dimethoxy-1,1'-binaphthyl - ≥95%(HPLC) , CAS No.75640-87-8

CAS: 75640-87-8 Cat. No.: S161287 Formula: C₂₂H₁₈O₂ Peso molecolare: 314.38 Beilstein Registry Number: 4704230 Numero EC: 695-618-6

GRADE & PURITY ≥95%(HPLC)

Synonyms

NSC37210 | NSC-37210 | BJAADAKPADTRCH-UHFFFAOYSA-N | NCGC00161024-04 | W-107866 | (S)-(-)-2,2'-Dimethoxy-1,1'-binaphthyl | 1,1'-Binaphthalene, 2,2'-dimethoxy- | 2,2'-Dimethoxy-1,1'-binaphthalene | NCGC00161134-01 | (R)-(+)-2,2'-Dimethoxy-1,1'-binaphthalen

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

NSC37210 | NSC-37210 | BJAADAKPADTRCH-UHFFFAOYSA-N | NCGC00161024-04 | W-107866 | (S)-(-)-2,2'-Dimethoxy-1,1'-binaphthyl | 1,1'-Binaphthalene, 2,2'-dimethoxy- | 2,2'-Dimethoxy-1,1'-binaphthalene | NCGC00161134-01 | (R)-(+)-2,2'-Dimethoxy-1,1'-binaphthalen

Specifiche e purezza

≥95%(HPLC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥95%(HPLC)

Nomi e identificatori

Pubchem Sid

508806789

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508806789

Sorrisi canonici

COC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)OC

IUPAC Name

2-methoxy-1-(2-methoxynaphthalen-1-yl)naphthalene

InChIKey

BJAADAKPADTRCH-UHFFFAOYSA-N

INCHI

1S/C22H18O2/c1-23-19-13-11-15-7-3-5-9-17(15)21(19)22-18-10-6-4-8-16(18)12-14-20(22)24-2/h3-14H,1-2H3

Isomeri SMILES

COC1=C(C2=CC=CC=C2C=C1)C3=C(C=CC4=CC=CC=C43)OC

WGK Germania

3

Peso molecolare

314.38

Beilstein

4704230

Reaxy-Rn

2060769

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2060769&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Anisoles Alkyl aryl ethers Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Anisole - Alkyl aryl ether - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
• 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

Obiettivi associati (umani)

HEK293 (82097 Activities)

Explore this target

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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Rotazione specifica [α]: -73° (C=1.2,THF)
• Punto di fusione (°C): 228-232°C
• Peso molecolare: 314.400 g/mol
• XLogP3: 6.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 314.131 Da
• Monoisotopic Mass: 314.131 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 24
• Formal Charge: 0
• Complexity: 371.000
• 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