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Details

Stereochemistry ACHIRAL
Molecular Formula C7H3BrClF3
Molecular Weight 259.451
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Bromo-4-chlorobenzotrifluoride

SMILES

FC(F)(F)C1=CC(Br)=C(Cl)C=C1

InChI

InChIKey=APSISOSWYXCEQX-UHFFFAOYSA-N
InChI=1S/C7H3BrClF3/c8-5-3-4(7(10,11)12)1-2-6(5)9/h1-3H

HIDE SMILES / InChI

Molecular Formula C7H3BrClF3
Molecular Weight 259.451
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 Sat Dec 16 12:33:31 GMT 2023
Edited
by admin
on Sat Dec 16 12:33:31 GMT 2023
Record UNII
ZP4MJL6EKM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Bromo-4-chlorobenzotrifluoride
Systematic Name English
Benzene, 2-bromo-1-chloro-4-(trifluoromethyl)-
Systematic Name English
NSC-59728
Code English
3-Bromo-4-chloro-α,α,α-trifluorotoluene
Common Name English
2-Bromo-1-chloro-4-(trifluoromethyl)benzene
Systematic Name English
Toluene, 3-bromo-4-chloro-α,α,α-trifluoro-
Systematic Name English
1-Bromo-2-chloro-5-trifluoromethylbenzene
Systematic Name English
3-Bromo-4-chloro-1-(trifluoromethyl)benzene
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
207-226-0
Created by admin on Sat Dec 16 12:33:31 GMT 2023 , Edited by admin on Sat Dec 16 12:33:31 GMT 2023
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FDA UNII
ZP4MJL6EKM
Created by admin on Sat Dec 16 12:33:31 GMT 2023 , Edited by admin on Sat Dec 16 12:33:31 GMT 2023
PRIMARY
NSC
59728
Created by admin on Sat Dec 16 12:33:31 GMT 2023 , Edited by admin on Sat Dec 16 12:33:31 GMT 2023
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PUBCHEM
67988
Created by admin on Sat Dec 16 12:33:31 GMT 2023 , Edited by admin on Sat Dec 16 12:33:31 GMT 2023
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CAS
454-78-4
Created by admin on Sat Dec 16 12:33:31 GMT 2023 , Edited by admin on Sat Dec 16 12:33:31 GMT 2023
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EPA CompTox
DTXSID80196495
Created by admin on Sat Dec 16 12:33:31 GMT 2023 , Edited by admin on Sat Dec 16 12:33:31 GMT 2023
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