65695-05-8

Basic information

• Product Name: METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE
• Synonyms: (E)-Methyl 4-(N'-hydroxycarbaMiMidoyl)benzoate;Benzoic acid,4-[(hydroxyaMino)iMinoMethyl]-, Methyl ester;Methyl 4-(N-hydroxycarbamimidoyl);METHYL 4-[AMINO(HYDROXYIMINO)METHYL]BENZENECARBOXYLATE;METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE;4-[(HYDROXYAMINO)IMINOMETHYL]-BENZOIC ACID, METHYL ESTER;Methyl 4-[amino(hydroxyimino)methyl]benzoate;Benzoic acid, 4-[(hydroxyamino)iminomethyl]-, methyl ester (9CI)
• CAS NO: 65695-05-8
• Molecular Formula: C₉H₁₀N₂O₃
• Molecular Weight: 194.19
• Product Categories: AMIDINE;pharmacetical
• Mol File: 65695-05-8.mol
• Article Data: 22

Chemical Properties

• Melting Point: 172-174
• Boiling Point: 381.5 °C at 760 mmHg
• Flash Point: 184.5 °C
• Appearance: /
• Density: 1.28 g/cm³
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• PKA: 13.88±0.50(Predicted)
• CAS DataBase Reference: METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE(CAS DataBase Reference)
• NIST Chemistry Reference: METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE(65695-05-8)
• EPA Substance Registry System: METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE(65695-05-8)

Safety Data

• Hazard Codes: Xi,T
• Statements: 25
• Safety Statements: 45
• HazardClass: IRRITANT
• Hazardous Substances Data: 65695-05-8(Hazardous Substances Data)

Usage

General Description

Methyl 4-[(Z)-amino(hydroxyimino)methyl]benzoate is a compound with the molecular formula C9H9NO3. It is a derivative of benzoic acid and contains a methyl ester group and an amino(hydroxyimino)methyl substituent, which is in the Z configuration. This chemical is commonly used as a reagent in organic synthesis and as an intermediate in the production of pharmaceuticals and agrochemicals. It has potential applications in medicinal chemistry and drug discovery due to its diverse chemical properties and potential biological activity. Additionally, its structure makes it a valuable building block for the synthesis of complex organic molecules.

Upstream product

• 1129-35-7 4-cyanobenzoic acid methyl ester 
• 619-65-8 4-cyanobenzoic Acid 
• 1443-80-7 4-cyanophenyl methyl ketone 

Downstream Products

• 569685-49-0 3-[(4-carbomethoxy)phenyl]-5-(4-phenyl-5-trifluoromethyl-2-thienyl)-1,2,4-oxadiazole 
• 1370330-82-7 methyl 4-(4,5-dihydro-5-oxo-4-(3-(5-oxo-3-phenyl-1,2,4-oxadiazol-4-yl)propyl)-1,2,4-oxadiazol-3-yl)benzoate 
• 1370330-83-8 C₁₈H₂₀N₄O₄ 
• 281234-03-5 methyl 4-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)benzoate 
• 340736-76-7 4-[5-(trifluoromethyl)-1,.2,4-oxadiazol-3-yl]benzoic acid 
• 95124-68-8 5-methyl-3-(4-carboxyphenyl)-1,2,4-oxadiazole 
• 478489-13-3 5-(3-Chloro-thiophen-2-yl)-3-[4-(methyl carboxy)-phenyl]-[1,2,4]-oxadiazole 
• 72094-49-6 4-(5-phenyl-1,2,4-oxadiazol-3-yl)benzoic acid 
• 340736-48-3 methyl 2-[(2S)-4-[2-(tert-butoxy)-2-oxoethyl]-1-[(2S)-3-(4-methoxyphenyl)-2-[[4-(5-trifluoromethyl-1,2,4-oxadiazol-3-yl)benzoyl]amino]propanoyl]-3-oxopiperazinyl]acetate 
• 340736-47-2 methyl 2-[(2S)-4-[2-(tert-butoxy)-2-oxoethyl]-1-[(2S)-3-(4-methoxyphenyl)-2-[[4-(5-phenyl-1,2,4-oxadiazol-3-yl)benzoyl]amino]propanoyl]-3-oxopiperazinyl]acetate 
• 340736-42-7 methyl 2-[(2S)-4-[2-(tert-butoxy)-2-oxoethyl]-1-[(2S)-3-(4-methoxyphenyl)-2-[[4-(5-thioxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)benzoyl]amino]propanoyl]-3-oxopiperazinyl]acetate 
• 340736-41-6 methyl 2-[(2S)-4-[2-(tert-butoxy)-2-oxoethyl]-1-[(2S)-3-(4-methoxyphenyl)-2-[[4-(5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl)benzoyl]amino]propanoyl]-3-oxopiperazinyl]acetate 

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