2-(4-Chlorophenyl)acetohydrazide - ≥98% , CAS No.57676-51-4

CAS: 57676-51-4 Cat. No.: C185327 分子式: C₈H₉ClN₂O 分子量: 184.62 EC番号: 867-693-7

GRADE & PURITY ≥98%

Synonyms

Z56346881 | BBL008411 | [p-Chlorophenyl]acetic acid hydrazide | KE-0780 | AKOS000117704 | STK042754 | 4-Chloro-benzeneacetic acid hydrazide | A869618 | J-505954 | 2-(4-Chlorophenyl)acetohydrazide # | DTXSID90332443 | 4-chlorophenylacetic acid hydrazide |

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

同義語

Z56346881 | BBL008411 | [p-Chlorophenyl]acetic acid hydrazide | KE-0780 | AKOS000117704 | STK042754 | 4-Chloro-benzeneacetic acid hydrazide | A869618 | J-505954 | 2-(4-Chlorophenyl)acetohydrazide # | DTXSID90332443 | 4-chlorophenylacetic acid hydrazide |

仕様と純度

≥98%

保管条件

Protected from light,Room temperature,Argon charged

入荷

Normal

純度

≥98%

名前と識別子

• パブケム・シド: 528755907
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/528755907
• カノニカル・スマイル: C1=CC(=CC=C1CC(=O)NN)Cl
• IUPAC Name: 2-(4-chlorophenyl)acetohydrazide
• InChIKey: ZXTSFZRZKFXXRG-UHFFFAOYSA-N
• INCHI: 1S/C8H9ClN2O/c9-7-3-1-6(2-4-7)5-8(12)11-10/h1-4H,5,10H2,(H,11,12)
• 異性体SMILES: C1=CC(=CC=C1CC(=O)NN)Cl
• 分子量: 184.62
• Reaxy-Rn: 2576232
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2576232&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 分類 Benzene and substituted derivatives
      • Subclass Phenylacetamides

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: Benzene and substituted derivatives
• Subclass: Phenylacetamides
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylacetamides
• Alternative Parents: Chlorobenzenes Aryl chlorides Carboxylic acid hydrazides Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylacetamide - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Carboxylic acid hydrazide - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Carbonyl group - Organic oxygen compound - Aromatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as phenylacetamides. These are amide derivatives of phenylacetic acids.
• 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

作用メカニズム

化学的性質と物理的性質

• 沸点（°C）: 394.888°C
• 分子量: 184.620 g/mol
• XLogP3: 1.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 184.04 Da
• Monoisotopic Mass: 184.04 Da
• Topological Polar Surface Area: 55.100 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 155.000
• 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