4-Bromo-3-hydroxy-2-naphthoic Acid - ≥97% , CAS No.2208-15-3

CAS: 2208-15-3 Cat. No.: B152464 Formula: C₁₁H₇BrO₃ Peso molecolare: 267.08 Beilstein Registry Number: 10(4)1192 Numero EC: 218-632-2

GRADE & PURITY ≥97%

Synonyms

2-Naphthalenecarboxylicacid,4-bromo-3-hydroxy- | AS-61810 | B3229 | NSC 53065 | SY053571 | SCHEMBL569691 | 4-Bromo-3-hydroxy-2-naphthoic acid | CAA20815 | 3-hydroxy-4-bromo-2-naphthalene carboxylic acid | AC-27915 | DTXSID80176575 | 4-bromo-3-hydroxy-2-na

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

2-Naphthalenecarboxylicacid,4-bromo-3-hydroxy- | AS-61810 | B3229 | NSC 53065 | SY053571 | SCHEMBL569691 | 4-Bromo-3-hydroxy-2-naphthoic acid | CAA20815 | 3-hydroxy-4-bromo-2-naphthalene carboxylic acid | AC-27915 | DTXSID80176575 | 4-bromo-3-hydroxy-2-na

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥97%

Nomi e identificatori

Pubchem Sid

488183016

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488183016

Sorrisi canonici

C1=CC=C2C(=C1)C=C(C(=C2Br)O)C(=O)O

IUPAC Name

4-bromo-3-hydroxynaphthalene-2-carboxylic acid

InChIKey

HBUFBIFPUAHIDX-UHFFFAOYSA-N

INCHI

1S/C11H7BrO3/c12-9-7-4-2-1-3-6(7)5-8(10(9)13)11(14)15/h1-5,13H,(H,14,15)

Isomeri SMILES

C1=CC=C2C(=C1)C=C(C(=C2Br)O)C(=O)O

Peso molecolare

267.08

Beilstein

10(4)1192

Reaxy-Rn

2694903

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2694903&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Naphthalenes
      • Subclass Naphthalenecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Naphthalenes
• Subclass: Naphthalenecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenecarboxylic acids
• Alternative Parents: Naphthols and derivatives Salicylic acid and derivatives O-bromophenols Aryl bromides Vinylogous acids Monocarboxylic acids and derivatives Carboxylic acids Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: 2-naphthalenecarboxylic acid - 2-naphthol - Hydroxybenzoic acid - Salicylic acid or derivatives - 2-bromophenol - Aryl halide - Aryl bromide - Vinylogous acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homopolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group one or more positions. 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

Proprietà chimiche e fisiche

• Solubilità: Soluble in Methanol
• Punto di fusione (°C): 231°C(lit.)
• Peso molecolare: 267.070 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 265.958 Da
• Monoisotopic Mass: 265.958 Da
• Topological Polar Surface Area: 57.500 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 256.000
• 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

Domande frequenti

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 2208-15-3, the molecular formula is C11H7BrO3, and the molecular weight is 267.08 g/mol. InChIKey HBUFBIFPUAHIDX-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.