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Basic Information
CAS No.: 34523-34-7
Name: 4-[1-(hydroxyamino)ethylidene]cyclohexa-2,5-dien-1-one
Article Data: 36
Molecular Structure:
Molecular Structure of 34523-34-7 (4-[1-(hydroxyamino)ethylidene]cyclohexa-2,5-dien-1-one)
Formula: C8H9NO2
Molecular Weight: 151.165
Synonyms: Acetophenone,4'-hydroxy-, oxime (7CI);1-(4-Hydroxyphenyl)-1-ethanone oxime;1-(4-Hydroxyphenyl)ethanone oxime;4'-Hydroxyacetophenone oxime;NSC 77904;p-Hydroxyacetophenone oxime;
Density: 1.246 g/cm3
Melting Point: 142-144°C
Boiling Point: 294.8 °C at 760 mmHg
Flash Point: 132.1 °C
PSA: 52.82000
LogP: 1.59040
Synthetic route
99-93-4

4-Hydroxyacetophenone

34523-34-7

4-hydroxyacetophenone oxime

Conditions
ConditionsYield
With hydroxylamine hydrochloride; sodium acetate In ethanol; water Reflux;100%
With hydroxylamine hydrochloride; sodium acetate In water for 1h; Heating;98%
With hydroxylamine hydrochloride; sodium acetate In ethanol; water Reflux;91%
99-93-4

4-Hydroxyacetophenone

A

103-90-2

4-acetaminophenol

B

34523-34-7

4-hydroxyacetophenone oxime

Conditions
ConditionsYield
With hydroxylamine hydrochloride In acetonitrile at 70℃; for 15h;A 90%
B 8%
With hydroxylamine hydrochloride at 70 - 110℃; Solvent; chemoselective reaction;
99-93-4

4-Hydroxyacetophenone

A

27642-27-9

N-Methyl 4-hydroxy benzamide

B

103-90-2

4-acetaminophenol

C

34523-34-7

4-hydroxyacetophenone oxime

Conditions
ConditionsYield
With hydroxylamine sulfate at 80℃; for 2.5h;A 15%
B 85%
C n/a
With hydroxylamine sulfate at 80℃; for 2.5h;A 15%
B 83%
C n/a
27642-27-9

N-Methyl 4-hydroxy benzamide

34523-34-7

4-hydroxyacetophenone oxime

Conditions
ConditionsYield
With hydrogenchloride; acetic acid In water at 75℃; for 10h; Retrobeckmann rearrangement;80%

hydroxylamine phosphate

99-93-4

4-Hydroxyacetophenone

34523-34-7

4-hydroxyacetophenone oxime

Conditions
ConditionsYield
With ammonium hydroxide In water21.0 g (92.6%)
With ammonium hydroxide In water21.0 g (92.6%)
With ammonium hydroxide In water21.0 g (92.6%)
98-86-2

acetophenone

99-93-4

4-Hydroxyacetophenone

34523-34-7

4-hydroxyacetophenone oxime

Conditions
ConditionsYield
With hydroxylamine hydrochloride In pyridine
34523-34-7

4-hydroxyacetophenone oxime

103-90-2

4-acetaminophenol

Conditions
ConditionsYield
With 1,1,1,3',3',3'-hexafluoro-propanol; perfluoropinacol; 2-methoxycarbonylphenylboronic acid In nitromethane at 20℃; for 24h; Beckmann Rearrangement; chemoselective reaction;99%
With 2,2-dichloro-1,3-dicyclohexylimidazolidine-4,5-dione In acetonitrile at 80℃; for 0.333333h; Inert atmosphere; Schlenk technique; Green chemistry;98%
With carbon tetrabromide; Eosin Y; N,N-dimethyl-formamide In acetonitrile at 20℃; for 14h; Beckmann Rearrangement; Irradiation; Inert atmosphere; Green chemistry;96%
34523-34-7

4-hydroxyacetophenone oxime

99-93-4

4-Hydroxyacetophenone

Conditions
ConditionsYield
With toluene-4-sulfonic acid at 20℃; for 0.0166667h; neat (no solvent);96%
With water; dihydrogen peroxide; iodine In acetonitrile at 20℃; for 12h;92%
With formic acid; silica gel for 0.05h; microwave irradiation;91%
34523-34-7

4-hydroxyacetophenone oxime

108-24-7

acetic anhydride

4-acetyloxyacetophenone oxime

Conditions
ConditionsYield
With m-nitrobenzene boronic acid at 20℃; for 12h;95%
34523-34-7

4-hydroxyacetophenone oxime

27642-27-9

N-Methyl 4-hydroxy benzamide

Conditions
ConditionsYield
With boron trifluoride diethyl etherate In diethyl ether at 20℃; for 1h; Beckmann rearrangement;95%
With trifluoroacetic acid In acetonitrile at 109.84℃; Beckmann Rearrangement; Autoclave;
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     China (Mainland)  |  Contact Details

    Business Type:Trading Company

    Tel:15914108025

    Address:229A, No.15, Xinbeli Industrial Zone, Xinshi Community, Dalang Street, Longhua District

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  • Ethanone,1-(4-hydroxyphenyl)-, oxime

  • Casno:

    34523-34-7

    Ethanone,1-(4-hydroxyphenyl)-, oxime

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Ethanone,1-(4-hydroxyphenyl)-, oximeAppearance:Off white to slight yellow solid Storage:Stored in shaded, cool and dry places Package:1L 5L 10L 25L bottle Application:pharma intermediate Transportation:Handle with cares to avoid damaging the packages

  • Chemical Co.Ltd

    China (Mainland)  |  Contact Details

    Business Type:Trading Company

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  • Paracetamol EP Impurity G

  • Casno:

    34523-34-7

    Paracetamol EP Impurity G

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    High purity Application:Pharmaceutical intermediates, Material synthesis and analyzing the expectant ingredients

    Novachemistry offers a broad range of specialty chemicals and customized synthesis services to a range of pharmaceutical, agrochemical and biochemical industries. Novachemistry has

  • NovaChemistry

    United Kingdom  |  Contact Details

    Business Type:Trading Company

    Tel:+44 (0)208 191 7890

    Address:Unit11, Ark Business Centre, Gorden Road, Loughborough, United Kingdom

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Specification

This chemical is called Ethanone,1-(4-hydroxyphenyl)-, oxime, and its systematic name is 4-[1-(hydroxyamino)ethylidene]cyclohexa-2,5-dien-1-one. With the molecular formula of C8H9NO2, its molecular weight is 151.16. The CAS registry number of this chemical is 34523-34-7. Additionally, its product categories are Aromatic Hydrazides, Hydrazines, Hydrazones and Oximes.

Other characteristics of the Ethanone,1-(4-hydroxyphenyl)-, oxime can be summarised as followings: (1)ACD/LogP: 0.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.04; (4)ACD/LogD (pH 7.4): 0.04; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 25.01; (8)ACD/KOC (pH 7.4): 24.99; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.591; (14)Molar Refractivity: 40.98 cm3; (15)Molar Volume: 121.2 cm3; (16)Polarizability: 16.24×10-24cm3; (17)Surface Tension: 52.6 dyne/cm; (18)Density: 1.246 g/cm3; (19)Flash Point: 132.1 °C; (20)Enthalpy of Vaporization: 62 kJ/mol; (21)Boiling Point: 294.8 °C at 760 mmHg; (22)Vapour Pressure: 0.000166 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C\1/C=C\C(=C(/NO)C)/C=C/1
2.InChI: InChI=1/C8H9NO2/c1-6(9-11)7-2-4-8(10)5-3-7/h2-5,9,11H,1H3
3.InChIKey: NOGIFJNJJZFUDN-UHFFFAOYAZ