METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE

Product Name: METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE
CAS No.: 65695-05-8
Chemical Name: METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE
Synonyms: Methyl 4-(N-hydroxycarbamimidoyl);Methyl 4-(N-hydroxycarbaMiMidoyl)benzoate;methyl 4-(N'-hydroxycarbamimidoyl)benzoate;Methyl 4-[amino(hydroxyimino)methyl]benzoate;Methyl 4-[(hydroxyamino)iminomethyl]benzoate;(E)-Methyl 4-(N'-hydroxycarbaMiMidoyl)benzoate;methyl 4-[(Z)-N'-hydroxycarbamimidoyl]benzoate;METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE;METHYL 4-[AMINO(HYDROXYIMINO)METHYL]BENZENECARBOXYLATE;4-[(HYDROXYAMINO)IMINOMETHYL]-BENZOIC ACID, METHYL ESTER
CBNumber: CB7715095
Molecular Formula: C9H10N2O3
Formula Weight: 194.19
MOL File: 65695-05-8.mol

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METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE Property

Melting point:: 172-174
Boiling point:: 327.2±44.0 °C(Predicted)
Density: 1.28±0.1 g/cm3(Predicted)
storage temp.: under inert gas (nitrogen or Argon) at 2–8 °C
pka: 13.88±0.50(Predicted)
form: solid
color: White

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Safety

Hazard Codes: Xi,T
Risk Statements: 25
Safety Statements: 45
HazardClass: IRRITANT
HS Code: 2921490090

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Hazard and Precautionary Statements (GHS)

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N-Bromosuccinimide Price

TRC

Product number: M321340
Product name: Methyl4-(N-Hydroxycarbamimidoyl)benzoate
Packaging: 25mg
Price: $45
Updated: 2021/12/16

Matrix Scientific

Product number: 046883
Product name: Methyl 4-[amino(hydroxyimino)methyl]-benzenecarboxylate
Purity: >95%
Packaging: 5g
Price: $363
Updated: 2021/12/16

Matrix Scientific

Product number: 046883
Product name: Methyl 4-[amino(hydroxyimino)methyl]-benzenecarboxylate
Purity: >95%
Packaging: 500mg
Price: $92
Updated: 2021/12/16

AK Scientific

Product number: HTS028063
Product name: methyl4-[(Z)-amino(hydroxyimino)methyl]benzoate
Packaging: 1mg
Price: $117
Updated: 2021/12/16

Matrix Scientific

Product number: 046883
Product name: Methyl 4-[amino(hydroxyimino)methyl]-benzenecarboxylate
Purity: >95%
Packaging: 1g
Price: $142
Updated: 2021/12/16

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METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE Chemical Properties,Usage,Production

Synthesis

1129-35-7

65695-05-8

General procedure for the synthesis of methyl 4-(N-hydroxyformamidinyl)benzoate (IV) from methyl 4-cyanobenzoate (III): methyl 4-cyanobenzoate (III) (2.50kg, 1wt) was dissolved in methanol (7.5L, 3vol) and diluted with methyl tert-butyl ether (9.3kg, 3.7wt). Aqueous hydroxylamine (50% solution; 1.23 kg, 0.5 wt, 1.2 eq.) was added slowly over about 0.5 h at 20-25 °C. The dosing line was flushed with methanol (1 kg, 0.4 wt) and the reaction was kept at 20-25 °C for about 12 hours. Upon completion of the reaction, the reaction mixture was cooled to 5±5°C and aged at this temperature for 3 hours. The product, methyl 4-(N'-hydroxyformamidinyl)benzoate (IV), was isolated by filtration, washed with methyl tert-butyl ether (2 x 5.5 kg, 2 x 2.2 wt) and dried under a stream of nitrogen for about 4 h to give the product (2.38 kg, 93% yield).

References

[1] Patent: WO2017/220446, 2017, A1. Location in patent: Page/Page column 26
[2] Journal of Labelled Compounds and Radiopharmaceuticals, 2012, vol. 55, # 2, p. 71 - 79
[3] Organic Letters, 2017, vol. 19, # 11, p. 2885 - 2888

METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE Preparation Products And Raw materials

Raw materials

Preparation Products

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METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE Suppliers

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65695-05-8, METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATERelated Search:

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METHYL 4-[(Z)-AMINO(HYDROXYIMINO)METHYL]BENZOATE

Methyl 4-(N-hydroxycarbaMiMidoyl)benzoate

4-[(HYDROXYAMINO)IMINOMETHYL]-BENZOIC ACID, METHYL ESTER

Methyl 4-[amino(hydroxyimino)methyl]benzoate

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methyl 4-[(Z)-N'-hydroxycarbamimidoyl]benzoate

Methyl 4-[(hydroxyamino)iminomethyl]benzoate

methyl 4-(N'-hydroxycarbamimidoyl)benzoate

65695-05-8

AMIDINE

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