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122-98-5

122-98-5 Structure

122-98-5 Structure
IdentificationMore
[Name]

2-Anilinoethanol
[CAS]

122-98-5
[Synonyms]

2-ANILINOETHANOL
2-HYDROXYETHYLANILINE
2-(PHENYLAMINO)ETHANOL
BETA-ANILINOETHANOL
BETA-HYDROXYETHYLANILINE
N-(2-HYDROXYETHYL)ANILINE
N-(B-HYROXYETHYL)ANILINE
N-HYDROXYETHYLANILINE
N-PHENYL-2-AMINOETHANOL
N-PHENYLETHANOLAMINE
PEA
PHENYLETHANOLAMINE
(r,s)-(+/-)-1-phenylethylamine
2-(phenylamino)-ethano
2-Anilino-aethanol
2-anilino-ethano
Aniline, N-(2-hydroxyethyl)-
Aniline, N-(beta-hydroxyethyl)-
Benzenamine, N-(2-hydroxyethyl)-
Emery 5700
[EINECS(EC#)]

204-588-1
[Molecular Formula]

C8H11NO
[MDL Number]

MFCD00002832
[Molecular Weight]

137.18
[MOL File]

122-98-5.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR YELLOW TO BROWN LIQUID
[Melting point ]

-30 °C
[Boiling point ]

150-152 °C10 mm Hg(lit.)
[density ]

1.094 g/mL at 25 °C(lit.)
[vapor density ]

>1 (vs air)
[vapor pressure ]

<0.01 mm Hg ( 20 °C)
[refractive index ]

n20/D 1.578(lit.)
[Fp ]

>230 °F
[storage temp. ]

Store below +30°C.
[solubility ]

4.5g/l
[form ]

clear liquid
[pka]

14.39±0.10(Predicted)
[color ]

Colorless to Red to Green
[PH]

10.2 (10g/l, H2O, 20℃)
[explosive limit]

1-6.8%(V)
[Water Solubility ]

53 g/L (20 ºC)
[BRN ]

774672
[InChIKey]

MWGATWIBSKHFMR-UHFFFAOYSA-N
[LogP]

0.9 at 23℃
[CAS DataBase Reference]

122-98-5(CAS DataBase Reference)
[NIST Chemistry Reference]

Ethanol, 2-(phenylamino)-(122-98-5)
[EPA Substance Registry System]

122-98-5(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

T
[Risk Statements ]

R24:Toxic in contact with skin.
R41:Risk of serious damage to eyes.
R48/20/21/22:Harmful: danger of serious damage to health by prolonged exposure through inhalation, and in contact with skin and if swallowed .
R36:Irritating to the eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

UN 2810 6.1/PG 2
[WGK Germany ]

1
[RTECS ]

KJ7175000
[Autoignition Temperature]

410 °C DIN 51794
[TSCA ]

Yes
[HazardClass ]

6.1
[PackingGroup ]

II
[HS Code ]

29221990
[Safety Profile]

Poison by skin contact, intraperitoneal, and intravenous routes. Moderately toxic by ingestion. A skin and severe eye irritant. Combustible when exposed to heat or flame. To fight fire, use dry chemical, water mist. When heated to decomposition it emits toxic fumes of NOx.
[Toxicity]

LD50 orally in Rabbit: 2230 mg/kg LD50 dermal Rabbit 68 mg/kg
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Aniline-->ETHYLENE OXIDE-->2-Phenoxyethylamine-->DIPHENYLIODONIUM TRIFLUOROMETHANESULFONATE-->3-PHENYL-2-OXAZOLIDINONE
[Preparation Products]

2-[(2R)-2-Hydroxy-3-[[4-(3-oxo-4-Morpho linyl)phenyl]aMino]propyl]-1H-isoindole-1 ,3(2H)-dione-->N-(2-Trimethylsiloxyethyl)aniline-->(R,E)-2-(benzo[d][1,3]dioxol-5-ylMethyleneaMino)-2-phenylethanol-->N-Ethyl-N-hydroxyethylaniline-->4,5-dichlorothiophene-2-carbonyl chloride
Hazard InformationBack Directory
[Chemical Properties]

CLEAR YELLOW TO BROWN LIQUID
[Uses]

N-Phenylethanolamine is used as an intermediate for dyes and other organic compounds. Further, it is used as a substrate for human olfactory uridine 5'-diphospho-glucuronosyltransferase.
[Definition]

ChEBI: 2-Anilinoethanol is an aralkylamine.
[Synthesis Reference(s)]

Journal of Medicinal Chemistry, 11, p. 87, 1968 DOI: 10.1021/jm00307a019
Journal of the American Chemical Society, 74, p. 5514, 1952
Tetrahedron Letters, 10, p. 4555, 1969 DOI: 10.1017/S0009838800024678
[Synthesis Reference(s)]

Synthetic Communications, 24, p. 1415, 1994 DOI: 10.1080/00397919408011745
[Flammability and Explosibility]

Notclassified
Spectrum DetailBack Directory
[Spectrum Detail]

2-Anilinoethanol(122-98-5)MS
2-Anilinoethanol(122-98-5)1HNMR
2-Anilinoethanol(122-98-5)13CNMR
2-Anilinoethanol(122-98-5)IR1
2-Anilinoethanol(122-98-5)IR2
2-Anilinoethanol(122-98-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Anilinoethanol, 98%(122-98-5)
[Alfa Aesar]

N-Phenylethanolamine, 98%(122-98-5)
[Sigma Aldrich]

122-98-5(sigmaaldrich)
[TCI AMERICA]

2-Anilinoethanol,>98.0%(GC)(122-98-5)
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