2′-Aminoacetophenone
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2′-Aminoacetophenone
structure -
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CAS No:
551-93-9
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Formula:
C8H9NO
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Chemical Name:
2′-Aminoacetophenone
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Synonyms:
Ethanone,1-(2-aminophenyl)-;Acetophenone,2′-amino-;Acetophenone,o-amino-;1-(2-Aminophenyl)ethanone;o-Aminoacetophenone;2′-Aminoacetophenone;o-Aminoacetylbenzene;2-Acetylaniline;o-Aminophenyl methyl ketone;1-Acetyl-2-aminobenzene;o-Acetylaniline;2-Aminophenyl methyl ketone;2-Acetylphenylamine;Methyl 2-aminophenyl ketone;2-(Methylcarbonyl)benzenamine;NSC 8820;1-(2-Aminophenyl)ethan-1-one
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CAS No:
Description
2'-Aminoacetophenone is an aromatic compound containing a ketone substituted by one alkyl group, and a phenyl group. 2'-Aminoacetophenone can be used as a breath biomarker for the detection of Ps. Aeruginosa infections in the cystic fibrosis lung[1].
Liquid
O-aminoacetophenone is an aromatic ketone that is acetophenone in which one of the ortho hydrogens of the phenyl group has been replaced by an amino group. It has a role as a bacterial metabolite. It is a substituted aniline and a member of acetophenones.
2′-Aminoacetophenone Basic Attributes
135.16
135.16
386122
209-002-8
69Y77091BC
8820
DTXSID4052213
YELLOW OILY LIQUID|YELLOW CRYSTALS
2922399090
Characteristics
43.1
1.6
Yellow to yellow-brown Liquid
1.1±0.1 g/cm3
20 °C
85-90 °C
>230 °F
1.571
SOL IN ETHER
0-6°C
UV: 6-168 (Organic Electronic Spectral Data, Phillips et al, John Wiley & Sons, New York) /3-Aminoacetophenone/
Safety Information
NONH for all modes of transport
3
36/37/38
26-36-24/25-37/39
AM5775000
Xi
Irritant
Stable at room temperature in closed containers under normal storage and handling conditions.
P261-P305 + P351 + P338
H315-H319-H335
The following wastewater treatment technologies have been investigated for acetophenone: concentration process: activated carbon. /Acetophenone/|The following wastewater treatment technologies have been investigated for acetophenone: concentration process: resin adsorption. /Acetophenone/
|Warning|H302 (30.91%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 134 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Drug Information
YIELDS 2-CARBOXAMIDO-4-METHYLQUINAZOLINE, 2-HYDROXYMETHYL-4-METHYLQUINAZOLINE, & 4-METHYLQUINAZOLINE IN PSEUDOMONAS. /FROM TABLE/|2-AMINO-3-HYDROXYACETOPHENONE WAS ISOLATED FROM URINE OF RATS GIVEN 15 MG 2-AMINOACETOPHENONE/KG/DAY FOR 4 DAYS & FROM THE SUPERNATANT OF CULTURES OF RAT LIVER MICROSOMES INCUBATED WITH 2-AMINOACETOPHENONE FOR 2 HR AT 37 °C.|IN CELL-FREE EXTRACTS OF BACILLUS SUBTILIS, 2'-AMINOACETOPHENONE WAS UTILIZED AS RAPIDLY AS AMINOACETONE.
2-aminoacetophenone
2′-Aminoacetophenone Use and Manufacturing
PREPN OF O- ISOMERS
Used as intermediate of oil soluble coupler
Ethanone, 1-(2-aminophenyl)-: ACTIVE
O-AMINOACETOPHENONE WAS ISOLATED FROM NEUTRAL OR ALKALINE LIQUID SWINE MANURE BY STEAM DISTILLATION & COLUMN CHROMATOGRAPHY & IDENTIFIED BY GAS CHROMATOGRAPHY & MASS SPECTROMETRY.
Computed Properties
Molecular Weight:135.16
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:135.068413911
Monoisotopic Mass:135.068413911
Topological Polar Surface Area:43.1
Heavy Atom Count:10
Complexity:133
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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