4-Hidroximetilbifenilo - ≥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 CE: 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

Argon charged,Room temperature

Shipped In

Normal

Visão geral

Reagente para a determinação quantitativa rápida de alquilos de lítio.
O bifenil-4-metanol foi utilizado como reagente para a determinação quantitativa rápida dos alquilos de lítio.

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

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Argon charged,Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

488182531

Pubchem Sid Url

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

Sorrisos canónicos

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

SMILES isoméricas

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

WGK Alemanha

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
    • Classe Benzene and substituted derivatives
      • Subclass Biphenyls and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: 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
• Descrição: 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 ação

Propriedades químicas e físicas

• Solubilidade: Soluble in Methanol
• Sensibilidade: air sensitive
• Ponto de ebulição (°C): 184 °C/11 mmHg
• Ponto de fusão (°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