7-Bromo-1-hydroxynaphthalene - ≥97% , CAS No.91270-69-8

CAS: 91270-69-8 Cat. No.: B590695 Summenformel: C₁₀H₇BrO Molekulargewicht: 223.07 EG-Nummer: 870-553-8

GRADE & PURITY ≥97%

Synonyms

2-Bromo-8-naphthol | 7-bromo-1-Naphthalenol | AKOS022506522 | BCP25448 | EN300-114088 | SY260438 | 1-Naphthalenol, 7-bromo- | DS-14515 | DTXSID10528861 | F16512 | 7-bromonaphthalen-1-ol | Z1269193289 | 7-Bromo-1-hydroxynaphthalene | FT-0731112 | STJXOXMPO

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

2-Bromo-8-naphthol | 7-bromo-1-Naphthalenol | AKOS022506522 | BCP25448 | EN300-114088 | SY260438 | 1-Naphthalenol, 7-bromo- | DS-14515 | DTXSID10528861 | F16512 | 7-bromonaphthalen-1-ol | Z1269193289 | 7-Bromo-1-hydroxynaphthalene | FT-0731112 | STJXOXMPO

Spezifikationen & Reinheit

≥97%

Storage

Protected from light,Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

• Kanonisches Lächeln: C1=CC2=C(C=C(C=C2)Br)C(=C1)O
• IUPAC Name: 7-bromonaphthalen-1-ol
• InChIKey: STJXOXMPODAEAK-UHFFFAOYSA-N
• INCHI: 1S/C10H7BrO/c11-8-5-4-7-2-1-3-10(12)9(7)6-8/h1-6,12H
• Isomere SMILES: C1=CC2=C(C=C(C=C2)Br)C(=C1)O
• Molekulargewicht: 223.07
• Reaxy-Rn: 3239487
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3239487&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Naphthalenes
• Subclass: Naphthols and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthols and derivatives
• Alternative Parents: 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Organooxygen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: 1-naphthol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aryl halide - Aryl bromide - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Aromatic homopolycyclic compound
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light sensitive
• Molekulargewicht: 223.070 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 221.968 Da
• Monoisotopic Mass: 221.968 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 160.000
• 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