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Details

Stereochemistry ACHIRAL
Molecular Formula C3H4ClNO
Molecular Weight 105.523
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-CHLOROETHYL ISOCYANATE

SMILES

ClCCN=C=O

InChI

InChIKey=BCMYXYHEMGPZJN-UHFFFAOYSA-N
InChI=1S/C3H4ClNO/c4-1-2-5-3-6/h1-2H2

HIDE SMILES / InChI

Molecular Formula C3H4ClNO
Molecular Weight 105.523
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:25:54 GMT 2023
Edited
by admin
on Fri Dec 15 18:25:54 GMT 2023
Record UNII
KJ4TMD25MS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-CHLOROETHYL ISOCYANATE
Systematic Name English
ISOCYANIC ACID, 2-CHLOROETHYL ESTER
Common Name English
CHLOROETHYLISOCYANATE
Systematic Name English
NSC-87418
Code English
1-CHLORO-2-ISOCYANATOETHANE
Systematic Name English
.BETA.-CHLOROETHYLISOCYANATE
Systematic Name English
CHLOROETHYL ISOCYANATE, 2-
Systematic Name English
ETHANOL, 2-CHLORO-, ISOCYANATE
Systematic Name English
ETHANE, 1-CHLORO-2-ISOCYANATO-
Systematic Name English
Code System Code Type Description
CAS
1943-83-5
Created by admin on Fri Dec 15 18:25:54 GMT 2023 , Edited by admin on Fri Dec 15 18:25:54 GMT 2023
PRIMARY
ECHA (EC/EINECS)
217-734-4
Created by admin on Fri Dec 15 18:25:54 GMT 2023 , Edited by admin on Fri Dec 15 18:25:54 GMT 2023
PRIMARY
NSC
87418
Created by admin on Fri Dec 15 18:25:54 GMT 2023 , Edited by admin on Fri Dec 15 18:25:54 GMT 2023
PRIMARY
PUBCHEM
16035
Created by admin on Fri Dec 15 18:25:54 GMT 2023 , Edited by admin on Fri Dec 15 18:25:54 GMT 2023
PRIMARY
FDA UNII
KJ4TMD25MS
Created by admin on Fri Dec 15 18:25:54 GMT 2023 , Edited by admin on Fri Dec 15 18:25:54 GMT 2023
PRIMARY
EPA CompTox
DTXSID2062080
Created by admin on Fri Dec 15 18:25:54 GMT 2023 , Edited by admin on Fri Dec 15 18:25:54 GMT 2023
PRIMARY