Sodium [1,1'-biphenyl]-2-olate - ≥98% , CAS No.132-27-4

CAS: 132-27-4 Cat. No.: S498926 Molecular Weight: 192.19 EC Number: 205-055-6 PubChem CID: 23675735

GRADE & PURITY ≥98%

Synonyms

Caswell No. 787 | NSC 1547 | OPP-sodium | BBL103071 | Sodium 2-hydroxydiphenyl | AKOS015913820 | F71217 | Q6581446 | 2-Hydroxydiphenyl sodium | Sodium 2-phenylphenate | sodium;2-phenylphenolate | CHEBI:82371 | o-Phenylphenol, sodium | CCRIS 693 | Dowicide

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyms

Caswell No. 787 | NSC 1547 | OPP-sodium | BBL103071 | Sodium 2-hydroxydiphenyl | AKOS015913820 | F71217 | Q6581446 | 2-Hydroxydiphenyl sodium | Sodium 2-phenylphenate | sodium;2-phenylphenolate | CHEBI:82371 | o-Phenylphenol, sodium | CCRIS 693 | Dowicide

Specifications & Purity

≥98%

Storage

Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488200483
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488200483
• Canonical Smiles: C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]
• IUPAC Name: sodium;2-phenylphenolate
• InChIKey: KSQXVLVXUFHGJQ-UHFFFAOYSA-M
• INCHI: 1S/C12H10O.Na/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10;/h1-9,13H;/q;+1/p-1
• Isomeric SMILES: C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]
• RTECS: DV7750000
• PubChem CID: 23675735
• Molecular Weight: 192.19
• Reaxy-Rn: 3574623

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Benzene and substituted derivatives
• Subclass: Biphenyls and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Biphenyls and derivatives
• Alternative Parents: Phenoxides Organooxygen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Biphenyl - Phenoxide - Organic alkali metal salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organooxygen compound - Aromatic homomonocyclic compound
• Description: 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: organic molecular entity

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

Chemical and Physical Properties

• Solubility: Soluble in water
• Melt Point(°C): 78°C(lit.)
• Molecular Weight: 192.190 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 192.055 Da
• Monoisotopic Mass: 192.055 Da
• Topological Polar Surface Area: 23.100 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 154.000
• 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: 2

XLogP3

References

1. Qianqian Wang, Hao Cui, Xiaolin Wang, Ziyu Hu, Peipei Tao, Mingyang Li, Jianlong Wang, Yaping Tang, Hong Xu, Xiangming He.  (2023)  Exceptional Light Sensitivity by Thiol–Ene Click Lithography.  Journal of the American Chemical Society,      [PMID:36625511] [10.1021/jacs.2c11887]

2. Jiujing Xu, Xueyu Wang, Cheng Chen, Rukang Jiang, Boya Wang, Bisheng Li, Leihong Zhao, Liguo Shen, Hongjun Lin, Banglin Chen.  (2025)  Hydrogen-bonded organic framework enables ultrathin polyamide membrane for efficient endocrine disrupting compounds removal.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.171832]