ChemicalBook--->CAS DataBase List--->24066-82-8

24066-82-8

24066-82-8 Structure

24066-82-8 Structure
IdentificationMore
[Name]

ETHYL ISOTHIOCYANATOACETATE
[CAS]

24066-82-8
[Synonyms]

ETHOXYCARBONYLMETHYL ISOTHIOCYANATE
ETHYL 2-ISOTHIOCYANATOACETATE
ETHYL ISOTHIOCYANATOACETATE
GLYNCS
ISOTHIOCYANATOACETIC ACID ETHYL ESTER
Carbethoxymethyl isothiocyanate
carbethoxymethylisothiocyanate
Carboethoxymethyl isothiocyanate
carboethoxymethylisothiocyanate
Ethyl isothiocyanoacetate
isothiocyanato-aceticaciethylester
2-Isothiocyanatoacetic acid ethyl ester
Isothiocyanoacetic acid ethyl
Isothiocyanoacetic acid ethyl ester
N-(Thioxomethylene)glycine ethyl ester
[EINECS(EC#)]

417-721-0
[Molecular Formula]

C5H7NO2S
[MDL Number]

MFCD00060677
[Molecular Weight]

145.18
[MOL File]

24066-82-8.mol
Chemical PropertiesBack Directory
[Boiling point ]

104-106 °C/7 mmHg (lit.)
[density ]

1.171 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.502(lit.)
[Fp ]

228 °F
[storage temp. ]

2-8°C
[form ]

clear liquid
[color ]

Colorless to Red to Green
[Specific Gravity]

1.171
[InChI]

InChI=1S/C5H7NO2S/c1-2-8-5(7)3-6-4-9/h2-3H2,1H3
[InChIKey]

IYPSSPPKMLXXRN-UHFFFAOYSA-N
[SMILES]

C(OCC)(=O)CN=C=S
[CAS DataBase Reference]

24066-82-8(CAS DataBase Reference)
[EPA Substance Registry System]

Acetic acid, isothiocyanato-, ethyl ester (24066-82-8)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

UN 2810 6.1/PG 2
[WGK Germany ]

3
[RTECS ]

AI5020000
[TSCA ]

TSCA listed
[REACH Registrations]

Inactive
[HazardClass ]

IRRITANT-HARMFUL
[PackingGroup ]

III
[HS Code ]

29309090
[Storage Class]

6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
[Toxicity]

rat,LDLo,subcutaneous,350mg/kg (350mg/kg),PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE)LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSIONBEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD,Archives Internationales de Pharmacodynamie et de Therapie. Vol. 35, Pg. 314, 1929.
Hazard InformationBack Directory
[Uses]

Ethyl isothiocyanatoacetate has been used in the synthesis of:
  • fused pyrimidines
  • ethyl (3-substituted 5-thioxo-1,2,4-triazolin-4-yl)acetates via addition-cyclization reaction with carboxylic acid hydrazides in the presence of sodium ethoxide
  • 3-O-amino-2-thiohydantoins
  • quinazoline, benzothienopyrimidine and benzofuropyrimidine
  • thiazolo[5,4-d]thiazole
Spectrum DetailBack Directory
[Spectrum Detail]

ETHYL ISOTHIOCYANATOACETATE(24066-82-8)MS
ETHYL ISOTHIOCYANATOACETATE(24066-82-8)IR1
ETHYL ISOTHIOCYANATOACETATE(24066-82-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

24066-82-8(sigmaaldrich)
[TCI AMERICA]

Ethyl Isothiocyanatoacetate,>98.0%(GC)(24066-82-8)
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