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Details

Stereochemistry ACHIRAL
Molecular Formula C7H3Cl2N
Molecular Weight 172.011
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,4-Dichlorobenzonitrile

SMILES

ClC1=CC=C(C#N)C(Cl)=C1

InChI

InChIKey=GRUHREVRSOOQJG-UHFFFAOYSA-N
InChI=1S/C7H3Cl2N/c8-6-2-1-5(4-10)7(9)3-6/h1-3H

HIDE SMILES / InChI

Molecular Formula C7H3Cl2N
Molecular Weight 172.011
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:23:19 GMT 2025
Edited
by admin
on Tue Apr 01 20:23:19 GMT 2025
Record UNII
GUC45NQ4S4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzonitrile, 2,4-dichloro-
Preferred Name English
2,4-Dichlorobenzonitrile
Systematic Name English
Code System Code Type Description
CAS
6574-98-7
Created by admin on Tue Apr 01 20:23:19 GMT 2025 , Edited by admin on Tue Apr 01 20:23:19 GMT 2025
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PUBCHEM
81050
Created by admin on Tue Apr 01 20:23:19 GMT 2025 , Edited by admin on Tue Apr 01 20:23:19 GMT 2025
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FDA UNII
GUC45NQ4S4
Created by admin on Tue Apr 01 20:23:19 GMT 2025 , Edited by admin on Tue Apr 01 20:23:19 GMT 2025
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ECHA (EC/EINECS)
229-493-2
Created by admin on Tue Apr 01 20:23:19 GMT 2025 , Edited by admin on Tue Apr 01 20:23:19 GMT 2025
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EPA CompTox
DTXSID30215943
Created by admin on Tue Apr 01 20:23:19 GMT 2025 , Edited by admin on Tue Apr 01 20:23:19 GMT 2025
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