1-(4-Chlorobutoxy)-2,4-bis(1,1-dimethylpropyl)benzene

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C20H33ClO
Molecular Weight	324.928
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(4-Chlorobutoxy)-2,4-bis(1,1-dimethylpropyl)benzene

Structure Search

SMILES

CCC(C)(C)C1=CC=C(OCCCCCl)C(=C1)C(C)(C)CC

InChI

InChIKey=WQXDZIXHDZKOGO-UHFFFAOYSA-N

InChI=1S/C20H33ClO/c1-7-19(3,4)16-11-12-18(22-14-10-9-13-21)17(15-16)20(5,6)8-2/h11-12,15H,7-10,13-14H2,1-6H3

HIDE SMILES / InChI

Molecular Formula	C20H33ClO
Molecular Weight	324.928
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 19:33:39 GMT 2025` Edited by `admin` on `Tue Apr 01 19:33:39 GMT 2025`
Record UNII	HD4T66AN22
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-(4-Chlorobutoxy)-2,4-bis(1,1-dimethylpropyl)benzene

Systematic Name

English

Benzene, 1-(4-chlorobutoxy)-2,4-bis(1,1-dimethylpropyl)-

Preferred Name

English

Code System Code Type Description

CAS

63217-25-4

Created by admin on Tue Apr 01 19:33:39 GMT 2025 , Edited by admin on Tue Apr 01 19:33:39 GMT 2025

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EPA CompTox

DTXSID2069787

Created by admin on Tue Apr 01 19:33:39 GMT 2025 , Edited by admin on Tue Apr 01 19:33:39 GMT 2025

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FDA UNII

HD4T66AN22

Created by admin on Tue Apr 01 19:33:39 GMT 2025 , Edited by admin on Tue Apr 01 19:33:39 GMT 2025

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PUBCHEM

113147

Created by admin on Tue Apr 01 19:33:39 GMT 2025 , Edited by admin on Tue Apr 01 19:33:39 GMT 2025

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ECHA (EC/EINECS)

264-021-9

Created by admin on Tue Apr 01 19:33:39 GMT 2025 , Edited by admin on Tue Apr 01 19:33:39 GMT 2025

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