Cas no 100139-54-6 (4-(Diethylamino)benzohydrazide)

4-(Diethylamino)benzohydrazide is a hydrazide derivative featuring a diethylamino substituent on the benzene ring, imparting unique electronic and steric properties. This compound is commonly utilized as an intermediate in organic synthesis, particularly in the preparation of heterocyclic compounds, dyes, and pharmaceuticals. Its hydrazide functionality enables participation in condensation reactions, forming hydrazones or serving as a nucleophile in coupling reactions. The diethylamino group enhances solubility in organic solvents and can influence reactivity through electron donation. This reagent is valued for its versatility in constructing complex molecular frameworks, making it useful in medicinal chemistry and materials science applications. Proper handling under inert conditions is recommended due to its potential sensitivity to oxidation.
4-(Diethylamino)benzohydrazide structure
100139-54-6 structure
Product Name:4-(Diethylamino)benzohydrazide
CAS No:100139-54-6
MF:C11H17N3O
MW:207.272182226181
MDL:MFCD01310809
CID:229333
PubChem ID:329748314
Update Time:2025-05-28

4-(Diethylamino)benzohydrazide Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid,4-(diethylamino)-, hydrazide
    • 4-(diethylamino)benzohydrazide
    • 4-(Diethylamino)benzoic acid hydrazide
    • 4-(Dimethylamino)benzoylhydrazide
    • AKOS B015280
    • Oprea1_494949
    • ART-CHEM-BB B015280
    • 4-(DIETHYLAMINO)BENZHYDRAZIDE
    • 4-Diethylamino-benzoic acid hydrazide
    • 9686782
    • IVK
    • IVK/9686782
    • MLS000878138
    • ZINC02574323
    • SMR000377068
    • A897582
    • 4-(Diethylamino)benzhydrazide, for HPLC derivatization, >=98.0% (HPLC)
    • HMS1786N15
    • F02
    • Z56832298
    • AKOS000116105
    • Q27460102
    • 4-(Diethylamino)benzenecarbohydrazide
    • CHEMBL1358859
    • PUNSOBLTEWFAMJ-UHFFFAOYSA-N
    • 4-(diethylamino) benzenecarbohydrazide
    • SCHEMBL961379
    • DTXSID90366369
    • Benzoic acid,4-(diethylamino)-,hydrazide
    • Benzoic acid, 4-(diethylamino)-, hydrazide
    • MFCD01310809
    • Benzoic acid, p-diethylamino-, hydrazide
    • CS-B1392
    • D77291
    • FT-0676309
    • 100139-54-6
    • F8889-0583
    • VS-05440
    • HMS2731K15
    • EN300-03686
    • BBL016647
    • ALBB-002669
    • STK426092
    • 4-(Diethylamino)benzohydrazide
    • MDL: MFCD01310809
    • Inchi: 1S/C11H17N3O/c1-3-14(4-2)10-7-5-9(6-8-10)11(15)13-12/h5-8H,3-4,12H2,1-2H3,(H,13,15)
    • InChI Key: PUNSOBLTEWFAMJ-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC(=CC=1)N(CC)CC)NN

Computed Properties

  • Exact Mass: 207.13700
  • Monoisotopic Mass: 207.137162174g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 5
  • Complexity: 196
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.4
  • Topological Polar Surface Area: 58.4?2

Experimental Properties

  • Melting Point: 99-101°C
  • PSA: 58.36000
  • LogP: 2.22750

4-(Diethylamino)benzohydrazide Security Information

  • Symbol: GHS07 GHS08
  • Signal Word:Warning
  • Hazard Statement: H302-H317-H351
  • Warning Statement: P280
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 22-40-43
  • Safety Instruction: S26; S36/37/39
  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT
  • Storage Condition:2-8°C
  • Safety Term:S26-36/37/39
  • Risk Phrases:R36/37/38

4-(Diethylamino)benzohydrazide Customs Data

  • HS CODE:2928000090
  • Customs Data:

    China Customs Code:

    2928000090

    Overview:

    2928000090 Other hydrazine(Hydrazine)And chlorhexidine(hydroxylamine)Organic derivatives of.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:6.5%.general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2928000090 other organic derivatives of hydrazine or of hydroxylamine VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

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