ISOPROPYL TRICHLOROACETATE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H7Cl3O2
Molecular Weight	205.467
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ISOPROPYL TRICHLOROACETATE

Structure Search

SMILES

CC(C)OC(=O)C(Cl)(Cl)Cl

InChI

InChIKey=JYXIYFNAIFVCAN-UHFFFAOYSA-N

InChI=1S/C5H7Cl3O2/c1-3(2)10-4(9)5(6,7)8/h3H,1-2H3

HIDE SMILES / InChI

Molecular Formula	C5H7Cl3O2
Molecular Weight	205.467
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 `Mon Mar 31 21:51:13 GMT 2025` Edited by `admin` on `Mon Mar 31 21:51:13 GMT 2025`
Record UNII	495Q31K6FH
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOPROPYL TRICHLOROACETATE

Systematic Name

English

NSC-50959

Preferred Name

English

ACETIC ACID, TRICHLORO-, ISOPROPYL ESTER

Systematic Name

English

ACETIC ACID, 2,2,2-TRICHLORO-, 1-METHYLETHYL ESTER

Systematic Name

English

ACETIC ACID, TRICHLORO-, 1-METHYLETHYL ESTER

Systematic Name

English

Classification Tree Code System Code

EPA PESTICIDE CODE

76802

Created by admin on Mon Mar 31 21:51:13 GMT 2025 , Edited by admin on Mon Mar 31 21:51:13 GMT 2025

Code System Code Type Description

FDA UNII

495Q31K6FH

Created by admin on Mon Mar 31 21:51:13 GMT 2025 , Edited by admin on Mon Mar 31 21:51:13 GMT 2025

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NSC

50959

Created by admin on Mon Mar 31 21:51:13 GMT 2025 , Edited by admin on Mon Mar 31 21:51:13 GMT 2025

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EPA CompTox

DTXSID1042073

Created by admin on Mon Mar 31 21:51:13 GMT 2025 , Edited by admin on Mon Mar 31 21:51:13 GMT 2025

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PUBCHEM

77598

Created by admin on Mon Mar 31 21:51:13 GMT 2025 , Edited by admin on Mon Mar 31 21:51:13 GMT 2025

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CAS

3974-99-0

Created by admin on Mon Mar 31 21:51:13 GMT 2025 , Edited by admin on Mon Mar 31 21:51:13 GMT 2025

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ECHA (EC/EINECS)

223-604-8

Created by admin on Mon Mar 31 21:51:13 GMT 2025 , Edited by admin on Mon Mar 31 21:51:13 GMT 2025

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