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ChemicalBook--->CAS DataBase List--->99-03-6

99-03-6

99-03-6 Structure

99-03-6 Structure
IdentificationMore
[Name]

3-Aminoacetophenone
[CAS]

99-03-6
[Synonyms]

1-(3-aminophenyl)ethanone
3-ACETYLANILINE
3'-AMINOACETOPHENONE
3-AMINOACETOPHENONE
LABOTEST-BB LTBB000557
M-AMINOACETOPHENONE
M-AMINOACETYLBENZENE
M-AMINOPHENYLMETHYLKETONE
1-(3-aminophenyl)-ethanon
3’-amino-acetophenon
3-aminoacetofenon
aminoacetophenone
beta-aminoacetophenone
Ethanone,1-(3-aminophenyl)-
m-acetylaniline
m-amino-acetophenon
m-Amiomethylphenylketone
3-Aminoacetophenone99%
3-Aminoacetophenone,~95%
3-Aminoacetophenone,97%
[EINECS(EC#)]

202-722-3
[Molecular Formula]

C8H9NO
[MDL Number]

MFCD00007796
[Molecular Weight]

135.16
[MOL File]

99-03-6.mol
Chemical PropertiesBack Directory
[Appearance]

yellow to light brown crystalline powder
[Melting point ]

94-98 °C(lit.)
[Boiling point ]

289-290 °C(lit.)
[density ]

1.1031 (rough estimate)
[vapor pressure ]

1.319Pa at 25℃
[refractive index ]

1.5700 (estimate)
[Fp ]

289-291°C
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

3.41±0.10(Predicted)
[color ]

Yellow to light brown crystalline powder
[Water Solubility ]

7.056g/L(37.5 ºC)
[Merck ]

14,413
[BRN ]

386009
[LogP]

0.83
[CAS DataBase Reference]

99-03-6(CAS DataBase Reference)
[NIST Chemistry Reference]

3-Aminoacetophenone(99-03-6)
[EPA Substance Registry System]

99-03-6(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S36/37:Wear suitable protective clothing and gloves .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

2
[RTECS ]

AM5800000
[Hazard Note ]

Irritant
[TSCA ]

T
[HazardClass ]

IRRITANT
[HS Code ]

29223900
[Safety Profile]

Moderately toxic by ingestion. Mddly toxic by skin contact. A skin and eye irritant. Mutation data reported. When heated to decomposition it emits toxic fumes of NO,. See also AROMATIC AMINES.
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Iron-->3-Nitroacetophenone
[Preparation Products]

3'-Acetamidoacetophenone-->APLPHA-BROMO-M-BENZOYLOXYACETOPHENONE-->3'-Hydroxyacetophenone-->2-(3-AMINOPHENYL)PYRIDINE-->3'-DIMETHYLAMINOACETOPHENONE-->3-BROMO-ALPHA-METHYLBENZYL ALCOHOL-->Benzenesulfonamide, 3-acetyl- (9CI)-->3-Vinylaniline-->3'-IODOACETOPHENONE-->TIMTEC-BB SBB000780-->N-(3-Acetylphenyl)-3-chlorobenzamide-->1-(3-ACETYLPHENYL)-3-PHENYLUREA-->N-(3-ACETYL-PHENYL)-2-CHLORO-ACETAMIDE-->Thiourea, N-(3-acetylphenyl)-N'-methyl-
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

m-Aminoacetophenone(99-03-6).msds
Hazard InformationBack Directory
[Chemical Properties]

3-Aminoacetophenone is yellow to light brown crystalline powder
[Uses]

3'-Aminoacetophenone has potential anti-bacterial properties in addition to being used in the synthesis of selective antagonists at human A2B adenosine receptors. As well, it is used in the synthesis of HIV-1 Integrase Inhibitors.
[Definition]

ChEBI: 3'-Aminoacetophenone is an aromatic ketone.
[Synthesis Reference(s)]

Synthetic Communications, 26, p. 973, 1996 DOI: 10.1080/00397919608003701
[General Description]

3′-Aminoacetophenone acts as bifunctional coupling reagent during the synthesis of pyrimidines.
[Purification Methods]

Recrystallise it from EtOH or aqueous EtOH (m 99.5o). The thiosemicarbazone has m 202-204o (from EtOH). [Beilstein 14 H 45, 14 IV 96.]
Spectrum DetailBack Directory
[Spectrum Detail]

3-Aminoacetophenone(99-03-6)MS
3-Aminoacetophenone(99-03-6)1HNMR
3-Aminoacetophenone(99-03-6)13CNMR
3-Aminoacetophenone(99-03-6)IR1
3-Aminoacetophenone(99-03-6)IR2
3-Aminoacetophenone(99-03-6)IR3
3-Aminoacetophenone(99-03-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

[Alfa Aesar]

[Sigma Aldrich]

99-03-6(sigmaaldrich)
[TCI AMERICA]

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