P-Nitrobiphenyl - ≥97% , CAS No.92-93-3

CAS: 92-93-3 Cat. No.: P188349 Molecular Weight: 199.2 EC Number: 202-204-7 PubChem CID: 7114

GRADE & PURITY ≥97%

Synonyms

4-(4-Nitrophenyl)benzene | EINECS 202-204-7 | AC-18837 | 4-Nitro-1,1'-biphenyl # | Z57127477 | FT-0631459 | PNB | QM80NUW6WZ | SCHEMBL167524 | WLN: WNR DR | FT-0672778 | P-NITROBIPHENYL [MI] | J-002964 | NITRO-1,1'-BIPHENYL, 4- | NSC1324 | NSC-1324 | MFCD

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Synonyms

4-(4-Nitrophenyl)benzene | EINECS 202-204-7 | AC-18837 | 4-Nitro-1, 1'-biphenyl # | Z57127477 | FT-0631459 | PNB | QM80NUW6WZ | SCHEMBL167524 | WLN: WNR DR | FT-0672778 | P-NITROBIPHENYL [MI] | J-002964 | NITRO-1, 1'-BIPHENYL, 4- | NSC1324 | NSC-1324 | MFCD

Specifications & Purity

≥97%

Storage

Room temperature

Shipped In

FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 488180297
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488180297
• Canonical Smiles: C1=CC=C(C=C1)C2=CC=C(C=C2)[N+](=O)[O-]
• IUPAC Name: 1-nitro-4-phenylbenzene
• InChIKey: BAJQRLZAPXASRD-UHFFFAOYSA-N
• INCHI: 1S/C12H9NO2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H
• Isomeric SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)[N+](=O)[O-]
• PubChem CID: 7114
• UN Number: 2811
• Packing Group: I
• Molecular Weight: 199.2

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: Nitrobenzenes Nitroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Biphenyl - Nitrobenzene - Nitroaromatic compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organonitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - 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: biphenyls

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

Associated Targets(non-human)

Ttr Transthyretin (14 Activities)

Discover Target: Ttr

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Chemical and Physical Properties

• Molecular Weight: 199.200 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 199.063 Da
• Monoisotopic Mass: 199.063 Da
• Topological Polar Surface Area: 45.800 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 210.000
• 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

References

1. Jiang Xinxiang, Li Guangxiao, Liu Saier, Song Yang, Su Yuanhai.  (2021)  Synthesis of arenediazonium salts and Suzuki- Miyaura cross-coupling reaction in microreactors.  Journal of Flow Chemistry,  11  (4): (843-853).  [PMID:] [10.1007/s41981-021-00160-7]

2. Haijiao Jia, Mengqi Cheng, Ran Zhao, Pingyi Zheng, Fangfang Ren, Yaqin Nan, Mengting Huang, Youxin Li.  (2024)  Excellent Pd-Loaded Magnetic Nanocatalyst on Multicarboxyl and Boronic Acid Biligands.  ACS Omega,      [PMID:38680317] [10.1021/acsomega.3c07133]

3. Xinyi Liu, Zhen Cheng, Nan Chen, Feng Xu, Jian Liu, Lei Ni, Juncheng Jiang.  (2024)  Process Hazard Assessment and Exothermic Mechanism of Propylene Glycol Butyl Ether Synthesis from Propylene Oxide.  INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH,      [PMID:] [10.1021/acs.iecr.3c04297]

4. Shangzai Wu, Xiaolong Gong, Guojian Ren, Linglong Yi, Qi Zhou, Qinhe Pan.  (2025)  Fluorescent Detection of Salicylaldehyde Based on Tb-Based Coordination Polymer.  ChemPlusChem,      [PMID:40536764] [10.1002/cplu.202500179]