ChemicalBook--->CAS DataBase List--->2103-99-3

2103-99-3

2103-99-3 Structure

2103-99-3 Structure
IdentificationMore
[Name]

2-AMINO-4-(4-CHLOROPHENYL)THIAZOLE
[CAS]

2103-99-3
[Synonyms]

2-AMINO-4-(4-CHLOROPHENYL)THIAZOLE
2-AMINO 4(P-CHLORO)PHENYL THIAZOLE
4-(4-CHLOROPHENYL)-1,3-THIAZOL-2-AMINE
4-(4-CHLORO-PHENYL)-THIAZOL-2-YLAMINE
AKOS B000490
AKOS BBS-00000674
AURORA 13234
BUTTPARK 18\03-88
IFLAB-BB F1912-0041
OTAVA-BB BB7010240509
TIMTEC-BB SBB000503
TOSLAB 14871
4-(4-chlorophenyl)-2-thiazolamin
4-(4-chlorophenyl)-2-thiazolamine
f1654
p-chlorophenyl-4amino-2thiazole
4-(4-CHLOROPHENYL)THIAZOL-2-AMINE
4-(4-chlorophenyl)-1,3-thiazol-2-ylamine
[Molecular Formula]

C9H7ClN2S
[MDL Number]

MFCD00047058
[Molecular Weight]

210.68
[MOL File]

2103-99-3.mol
Chemical PropertiesBack Directory
[Appearance]

white to light yellow crystal powde
[Melting point ]

169-171 °C(lit.)
[Boiling point ]

389.8±17.0 °C(Predicted)
[density ]

1.389±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[form ]

Powder
[pka]

3.95±0.10(Predicted)
[color ]

White to off-white
[λmax]

232nm(phosphate buffer sol.)(lit.)
[BRN ]

153889
[InChI]

1S/C9H7ClN2S/c10-7-3-1-6(2-4-7)8-5-13-9(11)12-8/h1-5H,(H2,11,12)
[InChIKey]

DWGWNNCHJPKZNC-UHFFFAOYSA-N
[SMILES]

Nc1nc(cs1)-c2ccc(Cl)cc2
[LogP]

3.411 (est)
[CAS DataBase Reference]

2103-99-3(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)
GHS06
[Signal word ]

Danger
[Hazard statements ]

H301-H315-H319-H335
[Precautionary statements ]

P301+P310+P330-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi,Xn
[Risk Statements ]

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

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

UN 2811 6.1/PG 3
[WGK Germany ]

3
[RTECS ]

XJ1026732
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[PackingGroup ]

III
[HS Code ]

29341000
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow crystal powde
[Uses]

2-Amino-4-(4-chlorophenyl)thiazole was used in the preparation of 2-chloroacetamido-4-(4-chlorophenyl)thiazole.
[Synthesis]

Carbamimidothioic acid

17356-08-0

4-Chloro-2'-bromoacetophenone

536-38-9

2-AMINO-4-(4-CHLOROPHENYL)THIAZOLE

2103-99-3

GENERAL METHOD: A mixture of thiourea (1.2 mmol) and α-bromo-4-chloroacetophenone (1 mmol) in ethanol (2 mL) was stirred and reacted at 70 °C for 1 hour. After completion of the reaction, the mixture was cooled to room temperature, poured into ice water, filtered to collect the precipitate precipitated, and dried to obtain the target product 2-amino-4-(4-chlorophenyl)thiazole. The product yields and physical properties were as follows: [6a (99% yield), white solid, melting point 150-152 °C (literature value 26: 149-150 °C); 6b (100% yield), white solid, melting point 162-165 °C (literature value 26: 163-164 °C); 6c (0.236 g, 93% yield), white solid, melting point 179-181 °C (literature value 26: 180-181 °C); 6d (98% yield), white solid, melting point 203.6-204.2 °C (literature value 28/22: 204.0-204.5 °C); 6e (94% yield), bright yellow solid, melting point 287-288 °C (literature values 26,27: 285-286 °C); 6f (100% yield), white solid, melting point 172-174°C (literature values 29-31: 172°C).

[References]

[1] Arkivoc, 2018, vol. 2018, # 7, p. 110 - 118
[2] Chinese Chemical Letters, 2014, vol. 25, # 1, p. 172 - 175
[3] Research on Chemical Intermediates, 2015, vol. 41, # 11, p. 8099 - 8109
[4] Molecules, 2017, vol. 22, # 5,
[5] Synthetic Communications, 2009, vol. 39, # 16, p. 2895 - 2906
Spectrum DetailBack Directory
[Spectrum Detail]

2-AMINO-4-(4-CHLOROPHENYL)THIAZOLE(2103-99-3)1HNMR
2-AMINO-4-(4-CHLOROPHENYL)THIAZOLE(2103-99-3)Raman
2-AMINO-4-(4-CHLOROPHENYL)THIAZOLE(2103-99-3)IR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2-Amino-4-(4-chlorophenyl)thiazole, 98%(2103-99-3)
[Sigma Aldrich]

2103-99-3(sigmaaldrich)
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2103-99-3