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Details

Stereochemistry ACHIRAL
Molecular Formula C10H7F2N3O
Molecular Weight 223.1789
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,4-DIFLUORO-.ALPHA.-(1H-1,2,4-TRIAZOLYL)ACETOPHENONE

SMILES

FC1=CC=C(C(=O)CN2C=NC=N2)C(F)=C1

InChI

InChIKey=XCHRPVARHBCFMJ-UHFFFAOYSA-N
InChI=1S/C10H7F2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6H,4H2

HIDE SMILES / InChI

Molecular Formula C10H7F2N3O
Molecular Weight 223.1789
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 Thu Jul 06 13:09:16 UTC 2023
Edited
by admin
on Thu Jul 06 13:09:16 UTC 2023
Record UNII
HXI8R9R915
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,4-DIFLUORO-.ALPHA.-(1H-1,2,4-TRIAZOLYL)ACETOPHENONE
Systematic Name English
VORICONAZOLE RELATED COMPOUND C [USP-RS]
Common Name English
VORICONAZOLE IMPURITY A [EP IMPURITY]
Common Name English
2',4'-DIFLUORO-2-(1H-1,2,4-TRIAZOL-1-YL)ACETOPHENONE
Systematic Name English
VORICONAZOLE RELATED COMPOUND C
Common Name English
VORICONAZOLE RELATED COMPOUND C [USP IMPURITY]
Common Name English
UK-51060
Code English
ETHANONE, 1-(2,4-DIFLUOROPHENYL)-2-(1H-1,2,4-TRIAZOL-1-YL)-
Systematic Name English
FLUCONAZOLE IMPURITY E [EP IMPURITY]
Common Name English
UK 51060
Code English
2',4'-DIFLUORO-2-(1,2,4-TRIAZOL-1-YL)ACETOPHENONE
Systematic Name English
1-(2,4-DIFLUOROPHENYL)-2-(1H-1,2,4-TRIAZOL-1-YL)ETHANONE
Systematic Name English
Code System Code Type Description
RS_ITEM_NUM
1718039
Created by admin on Thu Jul 06 13:09:16 UTC 2023 , Edited by admin on Thu Jul 06 13:09:16 UTC 2023
PRIMARY
FDA UNII
HXI8R9R915
Created by admin on Thu Jul 06 13:09:16 UTC 2023 , Edited by admin on Thu Jul 06 13:09:16 UTC 2023
PRIMARY
CAS
86404-63-9
Created by admin on Thu Jul 06 13:09:16 UTC 2023 , Edited by admin on Thu Jul 06 13:09:16 UTC 2023
PRIMARY
EPA CompTox
DTXSID70235529
Created by admin on Thu Jul 06 13:09:16 UTC 2023 , Edited by admin on Thu Jul 06 13:09:16 UTC 2023
PRIMARY
PUBCHEM
588080
Created by admin on Thu Jul 06 13:09:16 UTC 2023 , Edited by admin on Thu Jul 06 13:09:16 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
PARENT -> IMPURITY
For the calculation of contents, multiply the peak areas by 0.7
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP