1-Bromonaphthalene - ≥97% , CAS No.90-11-9

CAS: 90-11-9 Cat. No.: B109259 Formula: C₁₀H₇Br Peso molecolare: 207.07 Beilstein Registry Number: 1906414 Numero EC: 201-965-2

GRADE & PURITY ≥97%

Synonyms

AKOS000120011 | EN300-19782 | FT-0607535 | 1-bromonaphthalen | Naphthalene, 1-bromo- | bromonapthalene | MFCD00003868 | Naphthalen-1-yl bromide | Q21050994 | InChI=1/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7 | STR06472 | F9995-1655 | UNII-976Y53P08P | .a

Storage

Protected from light,Room temperature

Shipped In

Normal

Specifications

Sinonimi

AKOS000120011 | EN300-19782 | FT-0607535 | 1-bromonaphthalen | Naphthalene, 1-bromo- | bromonapthalene | MFCD00003868 | Naphthalen-1-yl bromide | Q21050994 | InChI=1/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7 | STR06472 | F9995-1655 | UNII-976Y53P08P | .a

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Protected from light,Room temperature

Spedito in

Normal

Purezza

≥97%

Nomi e identificatori

• Pubchem Sid: 504751220
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504751220
• Sorrisi canonici: C1=CC=C2C(=C1)C=CC=C2Br
• IUPAC Name: 1-bromonaphthalene
• InChIKey: DLKQHBOKULLWDQ-UHFFFAOYSA-N
• INCHI: 1S/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
• Isomeri SMILES: C1=CC=C2C(=C1)C=CC=C2Br
• WGK Germania: 3
• RTECS: QJ1545000
• Peso molecolare: 207.07
• Beilstein: 1906414
• Reaxy-Rn: 1906414
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1906414&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: Aryl bromides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Aryl halide - Aryl bromide - Hydrocarbon derivative - Organobromide - Organohalogen 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

Proprietà chimiche e fisiche

• Solubilità: Miscible with chloroform, ethanol, ether, benzene and ethyl acetate. Slightly miscible with water.
• Sensibilità: Light sensitive.
• Indice di rifrazione: 1.6550 to 1.6600
• Punto di infiammabilità (°F): 230 °F
• Punto di infiammabilità (°C): 110℃
• Punto di ebollizione (°C): 133-134 °C/10 mmHg
• Punto di fusione (°C): -2~-1°C
• Peso molecolare: 207.070 g/mol
• XLogP3: 4.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 205.973 Da
• Monoisotopic Mass: 205.973 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 133.000
• 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

Riferimenti

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2. Jialin Li, Shanshan Zhou, Hao Pang, Yuewen Huang, Bin Wang.  (2023)  Structure-property study of novel star-shaped block polycarboxylate superplasticizers prepared via ATRP in Portland cement.  Materials Today Communications,      [PMID:] [10.1016/j.mtcomm.2023.106042]

3. Zhou Xiu-Jie, Zhang Li-Shun, Song Wen-Fang, Huang Yan-Ping, Liu Zhao-Sheng.  (2018)  A polymer monolith incorporating stellate mesoporous silica nanospheres for use in capillary electrochromatography and solid phase microextraction of polycyclic aromatic hydrocarbons and organic small molecules.  MICROCHIMICA ACTA,  185  (9): (1-10).  [PMID:30178314] [10.1007/s00604-018-2964-6]

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