2-(2,3-Dichlorophenoxy)acetohydrazide - ≥98% , CAS No.153860-25-4

CAS: 153860-25-4 Cat. No.: D181719 分子式: C₈H₈Cl₂N₂O₂ 分子量: 235.1

グレード＆純度 ≥98%

Synonyms

AKOS003330184 | MS-7192 | 2-(2,3-dichlorophenoxy)acetohydrazide | FT-0716136 | STK443011 | A927236 | MFCD00245649 | 2,3-dichlorophenoxyacetic acid hyrazide | DTXSID40374191 | 2,3-Dichlorophenoxyaceticacidhydrazide | 2,3-Dichlorophenoxyacetic acid hydrazid

Storage

Room temperature

Shipped In

Normal

仕様

同義語

AKOS003330184 | MS-7192 | 2-(2,3-dichlorophenoxy)acetohydrazide | FT-0716136 | STK443011 | A927236 | MFCD00245649 | 2,3-dichlorophenoxyacetic acid hyrazide | DTXSID40374191 | 2,3-Dichlorophenoxyaceticacidhydrazide | 2,3-Dichlorophenoxyacetic acid hydrazid

仕様と純度

≥98%

保管条件

Room temperature

入荷

Normal

純度

≥98%

名前と識別子

カノニカル・スマイル

C1=CC(=C(C(=C1)Cl)Cl)OCC(=O)NN

IUPAC Name

2-(2,3-dichlorophenoxy)acetohydrazide

InChIKey

BHWOXDSGQNVQJA-UHFFFAOYSA-N

INCHI

1S/C8H8Cl2N2O2/c9-5-2-1-3-6(8(5)10)14-4-7(13)12-11/h1-3H,4,11H2,(H,12,13)

異性体SMILES

C1=CC(=C(C(=C1)Cl)Cl)OCC(=O)NN

分子量

235.1

Reaxy-Rn

8686800

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8686800&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 分類 Benzene and substituted derivatives
      • Subclass Halobenzenes
        • Level5 Chlorobenzenes
          • Level6 Dichlorobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 分類: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Chlorobenzenes
• Direct Parent: Dichlorobenzenes
• Alternative Parents: Phenoxy compounds Phenol ethers Alkyl aryl ethers Aryl chlorides Carboxylic acid hydrazides Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - 1,2-dichlorobenzene - Alkyl aryl ether - Aryl chloride - Aryl halide - Carboxylic acid hydrazide - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organochloride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
• 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

化学的性質と物理的性質

• 分子量: 235.060 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 233.996 Da
• Monoisotopic Mass: 233.996 Da
• Topological Polar Surface Area: 64.400 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 204.000
• 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