2,4,5-TRICHLOROACETOPHENONE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H5Cl3O
Molecular Weight	223.484
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,4,5-TRICHLOROACETOPHENONE

Structure Search

SMILES

CC(=O)C1=CC(Cl)=C(Cl)C=C1Cl

InChI

InChIKey=OPPQOJRXXODMKR-UHFFFAOYSA-N

InChI=1S/C8H5Cl3O/c1-4(12)5-2-7(10)8(11)3-6(5)9/h2-3H,1H3

HIDE SMILES / InChI

Molecular Formula	C8H5Cl3O
Molecular Weight	223.484
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 `Fri Dec 15 17:53:48 GMT 2023` Edited by `admin` on `Fri Dec 15 17:53:48 GMT 2023`
Record UNII	O9M4U4I96I
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4,5-TRICHLOROACETOPHENONE

Common Name

English

2',4',5'-TRICHLOROACETOPHENONE

Systematic Name

English

ETHANONE, 1-(2,4,5-TRICHLOROPHENYL)-

Systematic Name

English

ACETOPHENONE, 2',4',5'-TRICHLORO-

Systematic Name

English

1-(2,4,5-TRICHLOROPHENYL)ETHAN-1-ONE

Systematic Name

English

Code System Code Type Description

CAS

13061-28-4

Created by admin on Fri Dec 15 17:53:48 GMT 2023 , Edited by admin on Fri Dec 15 17:53:48 GMT 2023

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EPA CompTox

DTXSID2041335

Created by admin on Fri Dec 15 17:53:48 GMT 2023 , Edited by admin on Fri Dec 15 17:53:48 GMT 2023

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PUBCHEM

83096

Created by admin on Fri Dec 15 17:53:48 GMT 2023 , Edited by admin on Fri Dec 15 17:53:48 GMT 2023

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ECHA (EC/EINECS)

235-954-9

Created by admin on Fri Dec 15 17:53:48 GMT 2023 , Edited by admin on Fri Dec 15 17:53:48 GMT 2023

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FDA UNII

O9M4U4I96I

Created by admin on Fri Dec 15 17:53:48 GMT 2023 , Edited by admin on Fri Dec 15 17:53:48 GMT 2023

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