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Trichloroacetyl Isocyanate - >97.0%, high purity , CAS No.3019-71-4

  • ≥97%
Item Number
T162646
Grouped product items
SKUSizeAvailabilityPrice Qty
T162646-1g
1g
In stock
$25.90
T162646-2g
2g
In stock
$39.90
T162646-5g
5g
In stock
$75.90
T162646-10g
10g
In stock
$135.90
T162646-25g
25g
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
$241.90
T162646-50g
50g
In stock
$434.90
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Discover Trichloroacetyl Isocyanate by Aladdin Scientific in >97.0% for only $25.90. Available - in Ligands at Aladdin Scientific. Tags: Nitrogenous compounds, Non heterocyclic block.

View related series
Nitrogenous compounds Non heterocyclic block

Basic Description

SynonymsTrichloroacetyl isocyanate|3019-71-4|2,2,2-Trichloroacetyl isocyanate|Acetyl isocyanate, trichloro-|Trichloroacetylisocyanate|trichloroethanecarbonyl isocyanate|MFCD00002033|QXV1P5J6JL|Acetyl isocyanate, 2,2,2-trichloro-|Isocyanic Acid Trichloroacetyl Est
Specifications & Purity>97.0%
Storage TempStore at 2-8°C,Argon charged
Shipped InWet ice
Product Description

Trichloroacetyl isocyanate is commonly employed as in situ derivatizing reagent for the 13C NMR studies of alcohols, phenols and amines. It undergoes 1,5-cycloaddition reaction with anhydro-2-deoxy-D-erythro- and -L-threo-pent-1-enitols and 1,5-anhydro-2-deoxy-D- and -L-arabino-hex-1-enitols to yield [2+2] and [4+2] cycloadducts.
Derivatizing reagent for the structural assignment to hydroxy compounds by NMR.Used in negative ion chemical ionization mass spectrometry.

Names and Identifiers

IUPAC Name 2,2,2-trichloroacetyl isocyanate
INCHI InChI=1S/C3Cl3NO2/c4-3(5,6)2(9)7-1-8
InChi Key GRNOZCCBOFGDCL-UHFFFAOYSA-N
Canonical SMILES C(=NC(=O)C(Cl)(Cl)Cl)=O
Isomeric SMILES C(=NC(=O)C(Cl)(Cl)Cl)=O
WGK Germany 3
PubChem CID 76400
Molecular Weight 188.39
Beilstein 971201
Reaxy-Rn 971201

Certificates

Certificate of Analysis(COA)

Enter Lot Number to search for COA:

To view the certificate results,please click on a Lot number.For Lot numbers from past orders,please use our order status section

5 results found

Lot NumberCertificate TypeDateItem
C2427084Certificate of AnalysisJun 29, 2022 T162646
I2203437Certificate of AnalysisJun 29, 2022 T162646
I2203438Certificate of AnalysisJun 29, 2022 T162646
I2203439Certificate of AnalysisJun 29, 2022 T162646
I2203440Certificate of AnalysisJun 29, 2022 T162646

Chemical and Physical Properties

SolubilityMiscible with dichloromethane, ether, terahydrofuran and protic solvents.
SensitivityHeat & Moisture Sensiti
Refractive Index1.48
Flash Point(°F)150.8 °F
Flash Point(°C)65°(149°F)
Boil Point(°C)80-85 °C/20 mmHg

Safety and Hazards(GHS)

Pictogram(s) GHS06,   GHS08,   GHS05
Signal Danger
Hazard Statements

H311:Toxic in contact with skin

H331:Toxic if inhaled

H314:Causes severe skin burns and eye damage

H334:May cause allergy or asthma symptoms or breathing difficulties if inhaled

Precautionary Statements

P261:Avoid breathing dust/fume/gas/mist/vapors/spray.

P280:Wear protective gloves/protective clothing/eye protection/face protection.

P302+P352:IF ON SKIN: wash with plenty of water.

P321:Specific treatment (see ... on this label).

P405:Store locked up.

P501:Dispose of contents/container to ...

P264:Wash hands [and …] thoroughly after handling.

P260:Do not breathe dust/fume/gas/mist/vapors/spray.

P284:[In case of inadequate ventilation] Wear respiratory protection.

P271:Use only outdoors or in a well-ventilated area.

P301+P330+P331:IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.

P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P363:Wash contaminated clothing before reuse.

P403+P233:Store in a well-ventilated place. Keep container tightly closed.

P361+P364:Take off immediately all contaminated clothing and wash it before reuse.

P305+P354+P338:IF IN EYES: Immediately rinse with water for several minutes. Remove contact lenses if present and easy to do. Continue rinsing.

P302+P361+P354:IF ON SKIN: Take off Immediately all contaminated clothing. Immediately rinse with water for several minutes.

P316:Get emergency medical help immediately.

P342+P316:If experiencing respiratory symptoms: Get emergence medical help immediately.

WGK Germany 3
Reaxy-Rn 971201

Related Documents

 SDS

 Specification Sheet

References

1. Hassan M Badawi, Wolfgang Förner, Basel F Abu-Sharkh, Yahya S Oloriegbe,.  (2002-05-29)  Potential scans and potential energy distributions of normal vibrational modes of trichloroacetyl isocyanate..  Journal of molecular modeling,  8  ((2)): ( 44-49 ).  [PMID:12032597]

Solution Calculators

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