3-Bromo-2-naphthol - ≥98% , CAS No.30478-88-7

CAS: 30478-88-7 Cat. No.: B474670 Summenformel: C₁₀H₇BrO Molekulargewicht: 223.07 Beilstein Registry Number: 6(4)4302 EG-Nummer: 626-985-2

GRADE & PURITY ≥98%

Synonyms

T70735 | 3-Bromo-2-naphthol | Brom-beta-naphtol [German] | PQVIOPAWVAOHOA-UHFFFAOYSA-N | 2-Naphthalenol, 3-bromo- | 3-Brom-2-oxy-naphthalin | AKOS005259239 | Bromo-beta-naphthol | EN300-244700 | 3-bromonaphthalen-2-ol | SY055576 | 2-Naphthalenol,3-bromo-

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyme

T70735 | 3-Bromo-2-naphthol | Brom-beta-naphtol [German] | PQVIOPAWVAOHOA-UHFFFAOYSA-N | 2-Naphthalenol, 3-bromo- | 3-Brom-2-oxy-naphthalin | AKOS005259239 | Bromo-beta-naphthol | EN300-244700 | 3-bromonaphthalen-2-ol | SY055576 | 2-Naphthalenol,3-bromo-

Spezifikationen & Reinheit

≥98%

Storage

Argon charged,Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 488183355
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488183355
• Kanonisches Lächeln: C1=CC=C2C=C(C(=CC2=C1)O)Br
• IUPAC Name: 3-bromonaphthalen-2-ol
• InChIKey: PQVIOPAWVAOHOA-UHFFFAOYSA-N
• INCHI: 1S/C10H7BrO/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-6,12H
• Isomere SMILES: C1=CC=C2C=C(C(=CC2=C1)O)Br
• WGK Deutschland: 3
• Molekulargewicht: 223.07
• Beilstein: 6(4)4302
• Reaxy-Rn: 2081478
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2081478&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: O-bromophenols 1-hydroxy-2-unsubstituted benzenoids Aryl bromides Organooxygen compounds Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: 2-naphthol - 2-bromophenol - 1-hydroxy-2-unsubstituted benzenoid - 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;Moisture sensitive.
• Schmelzpunkt (°C): 82 °C
• Molekulargewicht: 223.070 g/mol
• XLogP3: 3.500
• 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