4-Hydroxymethylbiphenyl - ≥98% , CAS No.3597-91-9

CAS: 3597-91-9 Cat. No.: H134130 Fórmula: C₁₃H₁₂O Peso molecular: 184.24 Beilstein Registry Number: 6(4)4693 Número EC: 222-745-2

GRADE & PURITY ≥98%

Synonyms

4-Hydroxymethyl-biphenyl | AC-11843 | Z104492482 | UNII-GN8BN8XCF5 | 4-Phenylbenzyl alcohol | NSC84169 | NSC-84169 | 4-06-00-04693 (Beilstein Handbook Reference) | AKOS000121376 | biphenyl-4-yl methanol | MFCD00004660 | Q63391957 | (1,1'-Biphenyl)-4-metha

Storage

Room temperature,Argon charged

Shipped In

Normal

Descripción general

Reagent for the rapid quantitative determination of lithium alkyls.
Biphenyl-4-methanol was used as reagent for the rapid quantitative determination of lithium alkyls.

Specifications

Sinónimos

4-Hydroxymethyl-biphenyl | AC-11843 | Z104492482 | UNII-GN8BN8XCF5 | 4-Phenylbenzyl alcohol | NSC84169 | NSC-84169 | 4-06-00-04693 (Beilstein Handbook Reference) | AKOS000121376 | biphenyl-4-yl methanol | MFCD00004660 | Q63391957 | (1,1'-Biphenyl)-4-metha

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature,Argon charged

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

Pubchem Sid

488182531

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488182531

Sonrisas canónicas

C1=CC=C(C=C1)C2=CC=C(C=C2)CO

IUPAC Name

(4-phenylphenyl)methanol

InChIKey

AXCHZLOJGKSWLV-UHFFFAOYSA-N

INCHI

1S/C13H12O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10H2

Isómeros SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CO

WGK Alemania

3

RTECS

DV5425000

Peso molecular

184.24

Beilstein

6(4)4693

Reaxy-Rn

1937761

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1937761&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Biphenyls and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Biphenyls and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Biphenyls and derivatives
• Alternative Parents: Benzyl alcohols Primary alcohols Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Biphenyl - Benzyl alcohol - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Organooxygen compound - Alcohol - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Soluble in Methanol
• Sensibilidad: air sensitive
• Punto de ebullición (°C): 184 °C/11 mmHg
• Punto de fusión (°C): 104 °C
• Peso molecular: 184.230 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 184.089 Da
• Monoisotopic Mass: 184.089 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 153.000
• 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