4,4,5,5,6,6,6-Heptafluoro-1-(2-thienyl)-1,3-hexanedione

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H5F7O2S
Molecular Weight	322.199
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,4,5,5,6,6,6-Heptafluoro-1-(2-thienyl)-1,3-hexanedione

Structure Search

SMILES

FC(F)(F)C(F)(F)C(F)(F)C(=O)CC(=O)C1=CC=CS1

InChI

InChIKey=QHOQGOZSTQAYRH-UHFFFAOYSA-N

InChI=1S/C10H5F7O2S/c11-8(12,9(13,14)10(15,16)17)7(19)4-5(18)6-2-1-3-20-6/h1-3H,4H2

HIDE SMILES / InChI

Molecular Formula	C10H5F7O2S
Molecular Weight	322.199
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 20:01:51 GMT 2025` Edited by `admin` on `Tue Apr 01 20:01:51 GMT 2025`
Record UNII	9XDK54AX2L
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4,4,5,5,6,6,6-Heptafluoro-1-(2-thienyl)-1,3-hexanedione

Systematic Name

English

NSC-9187

Preferred Name

English

1,3-Hexanedione, 4,4,5,5,6,6,6-heptafluoro-1-(2-thienyl)-

Systematic Name

English

Code System Code Type Description

FDA UNII

9XDK54AX2L

Created by admin on Tue Apr 01 20:01:51 GMT 2025 , Edited by admin on Tue Apr 01 20:01:51 GMT 2025

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PUBCHEM

68411

Created by admin on Tue Apr 01 20:01:51 GMT 2025 , Edited by admin on Tue Apr 01 20:01:51 GMT 2025

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CAS

559-94-4

Created by admin on Tue Apr 01 20:01:51 GMT 2025 , Edited by admin on Tue Apr 01 20:01:51 GMT 2025

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EPA CompTox

DTXSID7060332

Created by admin on Tue Apr 01 20:01:51 GMT 2025 , Edited by admin on Tue Apr 01 20:01:51 GMT 2025

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NSC

9187

Created by admin on Tue Apr 01 20:01:51 GMT 2025 , Edited by admin on Tue Apr 01 20:01:51 GMT 2025

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