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17609-80-2

17609-80-2 Structure

17609-80-2 Structure
IdentificationMore
[Name]

4-Amino-3-chlorophenol
[CAS]

17609-80-2
[Synonyms]

4-AMINO-3-CHLOROPHENOL
AMINO(4-)-3-CHLOROPHENOL
3-chloro-4-aminophenol
4-amino-3-chloro-pheno
[EINECS(EC#)]

241-583-3
[Molecular Formula]

C6H6ClNO
[MDL Number]

MFCD00801116
[Molecular Weight]

143.57
[MOL File]

17609-80-2.mol
Chemical PropertiesBack Directory
[Melting point ]

159-160℃
[Boiling point ]

287.3±25.0 °C(Predicted)
[density ]

1.406±0.06 g/cm3(Predicted)
[RTECS ]

SJ5710000
[storage temp. ]

Keep in dark place,Sealed in dry,2-8°C
[solubility ]

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

Crystalline Powder
[pka]

9.26±0.18(Predicted)
[color ]

White
[Stability:]

Hygroscopic
[InChI]

InChI=1S/C6H6ClNO/c7-5-3-4(9)1-2-6(5)8/h1-3,9H,8H2
[InChIKey]

PNLPXABQLXSICH-UHFFFAOYSA-N
[SMILES]

C1(O)=CC=C(N)C(Cl)=C1
[CAS DataBase Reference]

17609-80-2(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H312-H315-H319-H332-H335
[Precautionary statements ]

P261-P280-P304+P340-P305+P351+P338-P405-P501a
[HazardClass ]

6.1
[HS Code ]

2922290090
Hazard InformationBack Directory
[Chemical Properties]

Light yellow solid
[Uses]

4-Amino-3-Chlorophenol acts as a synthetic reagent for the preparation of Benzothiazole-based ureas as potential ABAD/17β-HSD10 modulators for Alzheimer''s disease treatment.
[Application]

The 4-amino-3-chlorophenol is a crucial intermediate for preparing a tyrosine kinase inhibitor, tivozanib, and a late liver cancer drug, lenvatinib. As a crucial pharmaceutical chemical intermediate, 4-amino-3-chlorophenol is widely applied to the design and synthesis of medicaments for resisting tumors, cardiovascular diseases, neurological diseases, and the like.
[Synthesis]

Starting from o-chloronitrobenzene with the introduction of hydroxyl groups in the presence of strong acids and molybdenum salts as catalysts could synthesize 4-amino-3-chlorophenol. Beside, using m-chlorophenol as a starting material and introducing hydroxyl on a benzene ring through diazotization and coupling could synthesize 4-Amino-3-chlorophenol.    
Spectrum DetailBack Directory
[Spectrum Detail]

4-Amino-3-chlorophenol(17609-80-2)1HNMR
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