2,2,2-TRICHLOROETHANOL

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C2H3Cl3O
Molecular Weight	149.404
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,2,2-TRICHLOROETHANOL

Structure Search

SMILES

OCC(Cl)(Cl)Cl

InChI

InChIKey=KPWDGTGXUYRARH-UHFFFAOYSA-N

InChI=1S/C2H3Cl3O/c3-2(4,5)1-6/h6H,1H2

HIDE SMILES / InChI

Molecular Formula	C2H3Cl3O
Molecular Weight	149.404
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 15:08:16 UTC 2023` Edited by `admin` on `Fri Dec 15 15:08:16 UTC 2023`
Record UNII	AW835AJ62N
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2,2,2-TRICHLOROETHANOL

Systematic Name

English

ETHANOL, 2,2,2-TRICHLORO-

Systematic Name

English

2,2,2-TRICHLOROETHANOL [MI]

Common Name

English

NSC-66407

Code

English

2,2,2-trichloroethanol [WHO-DD]

Common Name

English

Classification Tree Code System Code

NCI_THESAURUS

C29756

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

Code System Code Type Description

MERCK INDEX

m11073

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

PRIMARY

Merck Index

CHEBI

28094

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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MESH

C005849

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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FDA UNII

AW835AJ62N

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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EVMPD

SUB90014

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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NSC

66407

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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PUBCHEM

8259

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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NCI_THESAURUS

C83510

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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EPA CompTox

DTXSID1021950

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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WIKIPEDIA

2,2,2-TRICHLOROETHANOL

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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SMS_ID

100000140643

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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CAS

115-20-8

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

PRIMARY

ECHA (EC/EINECS)

204-071-0

Created by admin on Fri Dec 15 15:08:16 UTC 2023 , Edited by admin on Fri Dec 15 15:08:16 UTC 2023

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Interaction Type:

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Comments:

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Qualification:

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Amount:


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PARENT -> METABOLITE

Related Record Type Details


					AW835AJ62N

2,2,2-TRICHLOROETHANOL

ACTIVE MOIETY