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Details

Stereochemistry ACHIRAL
Molecular Formula C3Cl3NO2
Molecular Weight 188.397
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of TRICHLOROACETYL ISOCYANATE

SMILES

ClC(Cl)(Cl)C(=O)N=C=O

InChI

InChIKey=GRNOZCCBOFGDCL-UHFFFAOYSA-N
InChI=1S/C3Cl3NO2/c4-3(5,6)2(9)7-1-8

HIDE SMILES / InChI

Molecular Formula C3Cl3NO2
Molecular Weight 188.397
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Hybrid solution/solid-phase synthesis of oligosaccharides by using trichloroacetyl isocyanate as sequestration-enabling reagent of sugar alcohols.
2005 Mar 4
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:42:52 UTC 2023
Edited
by admin
on Fri Dec 15 19:42:52 UTC 2023
Record UNII
QXV1P5J6JL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRICHLOROACETYL ISOCYANATE
Systematic Name English
.ALPHA.,.ALPHA.,.ALPHA.-TRICHLOROACETYL ISOCYANATE
Systematic Name English
2,2,2-TRICHLOROACETYL ISOCYANATE
Systematic Name English
ACETYL ISOCYANATE, 2,2,2-TRICHLORO-
Systematic Name English
ACETIC ACID, TRICHLORO-, ANHYDRIDE WITH ISOCYANIC ACID
Common Name English
ISOCYANIC ACID, ANHYDRIDE WITH TRICHLOROACETIC ACID
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
221-165-7
Created by admin on Fri Dec 15 19:42:52 UTC 2023 , Edited by admin on Fri Dec 15 19:42:52 UTC 2023
PRIMARY
EPA CompTox
DTXSID7062790
Created by admin on Fri Dec 15 19:42:52 UTC 2023 , Edited by admin on Fri Dec 15 19:42:52 UTC 2023
PRIMARY
CAS
3019-71-4
Created by admin on Fri Dec 15 19:42:52 UTC 2023 , Edited by admin on Fri Dec 15 19:42:52 UTC 2023
PRIMARY
PUBCHEM
76400
Created by admin on Fri Dec 15 19:42:52 UTC 2023 , Edited by admin on Fri Dec 15 19:42:52 UTC 2023
PRIMARY
FDA UNII
QXV1P5J6JL
Created by admin on Fri Dec 15 19:42:52 UTC 2023 , Edited by admin on Fri Dec 15 19:42:52 UTC 2023
PRIMARY