ChemicalBook--->CAS DataBase List--->96-50-4

96-50-4

96-50-4 Structure

96-50-4 Structure
IdentificationMore
[Name]

2-Aminothiazole
[CAS]

96-50-4
[Synonyms]

1,3-THIAZOL-2-YLAMINE
2-AMINOTHAZOLE
2-AMINOTHIAZOL
2-AMINOTHIAZOLE
2-THIAZOLAMINE
2-THIAZOLYLAMINE
2-THIAZYLAMINE
2-THIOZOLYLAMINE
ABADOLE
AKOS 204-05
AKOS BBS-00004392
AURORA KA-677
AURORA KA-7822
BASEDOL
THIAZYLAMINE
1,3-Thiazol-2-amine
2-Amino-1,3-thiazole
4-Thiazolin-2-onimine
Abadol
aminothiazol
[EINECS(EC#)]

202-511-6
[Molecular Formula]

C3H4N2S
[MDL Number]

MFCD00005325
[Molecular Weight]

100.14
[MOL File]

96-50-4.mol
Chemical PropertiesBack Directory
[Appearance]

brown crystalline powder, grains, lumps or flakes
[Melting point ]

91-93 °C (lit.)
[Boiling point ]

117 °C (15.002 mmHg)
[bulk density]

600kg/m3
[density ]

1.241 (estimate)
[vapor pressure ]

<1 hPa (20 °C)
[refractive index ]

1.5300 (estimate)
[Fp ]

117°C/15mm
[storage temp. ]

Hormones
[solubility ]

1 M HCl: soluble50mg/mL, clear (dark yellow-brown)
[form ]

Crystalline Powder, Grains, Lumps or Flakes
[pka]

5.36(at 20℃)
[color ]

Brown
[PH]

9.6 (100g/l, H2O, 20℃)
[Water Solubility ]

100 g/L (20 ºC)
[Detection Methods]

GC,NMR
[Merck ]

14,479
[BRN ]

105738
[InChI]

1S/C3H4N2S/c4-3-5-1-2-6-3/h1-2H,(H2,4,5)
[InChIKey]

RAIPHJJURHTUIC-UHFFFAOYSA-N
[SMILES]

[s]1[c]([nH]cc1)=N
[LogP]

0.380
[CAS DataBase Reference]

96-50-4(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Aminothiazole(96-50-4)
[Storage Precautions]

Store under nitrogen;Light sensitive
[EPA Substance Registry System]

96-50-4(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302
[Precautionary statements ]

P301+P312+P330
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R22:Harmful if swallowed.
R36:Irritating to the eyes.
R36/37:Irritating to eyes and respiratory system .
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37:Wear suitable protective clothing and gloves .
S39:Wear eye/face protection .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[RTECS ]

XJ2100000
[F ]

8-9
[Autoignition Temperature]

600 °C
[Hazard Note ]

Irritant
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29341000
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
[Toxicity]

LD50 orally in Rabbit: 480 mg/kg
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Thiourea-->Chloroacetaldehyde
[Preparation Products]

ethyl 2-(2-aminothiazol-5-ylthio)acetate-->BASIC RED 29-->2-Amino-5-nitrothiazole-->2-Amino-((1-carboxy-1-methyl ethoxy)imino)-4-thiazoleacetic acid-->3-(-Hydroxyphenethyl)-2-imino thiazolidine-->2-Amino-5-bromothiazole monohydrobromide-->2-Chloro-5-nitrothiazole-->1,3-Thiazole-2-carbaldehyde-->Cationic Violet 3BL-->2-Amino-5-bromothiazole-->Imidazo[2,1-b][1,3]thiazole-6-carboxylic acid-->Nitazoxanide Impurity-->Oxazole-2-amine-->CHEMBRDG-BB 4024592-->4,5,6,7-tetrachloro-2-(1,3-thiazol-2-yl)isoindole-1,3-dione-->2,2,2-trichloro-N-1,3-thiazol-2-ylacetamide-->2-Pyridinamine, N-(5-bromo-2-thiazolyl)--->1H-Benz[de]isoquinoline-1,3(2H)-dione,2-(2-thiazolyl)-
Hazard InformationBack Directory
[General Description]

Light brown crystals or brown granular solid.
[Reactivity Profile]

2-AMINOTHIAZOLE(96-50-4) reacts violently when nitrated with nitric or nitric-sulfuric acids. 2-AMINOTHIAZOLE(96-50-4) is also incompatible with strong oxidizing agents, strong acids, acid chlorides and acid anhydrides.
[Air & Water Reactions]

Insoluble in water.
[Fire Hazard]

Flash point data for this chemical are not available; however, 2-AMINOTHIAZOLE is probably combustible.
[Chemical Properties]

brown crystalline powder, grains, lumps or flakes
[Uses]

2-Aminothiazole is a heterocyclic amine and is the beginning reagent for the synthesis of many pharmaceutical and agricultural related compounds.
[Uses]

antithyroid agent
[Uses]

Usually used in the synthesis of 2-aminothiazole-modified silica gel,and aslo used in Ulmann coupling with 2-chlorobenzoic acids mediated by ultrasonic irradiation.
[Definition]

ChEBI: A primary amino compound that is 1,3-thiazole substituted by an amino group at position 2.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 76, p. 693, 1954 DOI: 10.1021/ja01632a016
[Biochem/physiol Actions]

2-Aminothiazoles are potent cyclin-dependent kinase 5 inhibitors and are therapeutic agents for the treatment of Alzheimer′s disease and other neurodegenerative disorders.
[Safety Profile]

Poison by ingestion andintraperitoneal routes. Mutation data reported.Spontaneous ignition occurs at 100°. Mixtures with nitricacid or nitric acid + sulfuric acid explode on heating.Incompatible with HNO3 and H2SO4. When heated todecomposition it emi
[Purification Methods]

It crystallises from pet ether (b 100-120o), or EtOH. [Beilstein 27 III/IV 4574.]
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Aminothiazole(96-50-4).msds
Spectrum DetailBack Directory
[Spectrum Detail]

2-Aminothiazole(96-50-4)MS
2-Aminothiazole(96-50-4)1HNMR
2-Aminothiazole(96-50-4)13CNMR
2-Aminothiazole(96-50-4)IR1
2-Aminothiazole(96-50-4)IR2
2-Aminothiazole(96-50-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2-Aminothiazole, 97%(96-50-4)
[Alfa Aesar]

2-Aminothiazole, 97%(96-50-4)
[Sigma Aldrich]

96-50-4(sigmaaldrich)
[TCI AMERICA]

2-Aminothiazole,>98.0%(T)(96-50-4)
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