4-(4-Hexyloxyphenyl)benzonitrile

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H21NO
Molecular Weight	279.3761
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(4-Hexyloxyphenyl)benzonitrile

Structure Search

SMILES

CCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

InChI

InChIKey=YUYXUPYNSOFWFV-UHFFFAOYSA-N

InChI=1S/C19H21NO/c1-2-3-4-5-14-21-19-12-10-18(11-13-19)17-8-6-16(15-20)7-9-17/h6-13H,2-5,14H2,1H3

HIDE SMILES / InChI

Molecular Formula	C19H21NO
Molecular Weight	279.3761
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 `Wed Apr 02 11:35:20 GMT 2025` Edited by `admin` on `Wed Apr 02 11:35:20 GMT 2025`
Record UNII	SK3K8V5U78
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4-(4-Hexyloxyphenyl)benzonitrile

Systematic Name

English

[1,1?-Biphenyl]-4-carbonitrile, 4?-(hexyloxy)-

Preferred Name

English

4?-(Hexyloxy)[1,1?-biphenyl]-4-carbonitrile

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID6068307

Created by admin on Wed Apr 02 11:35:20 GMT 2025 , Edited by admin on Wed Apr 02 11:35:20 GMT 2025

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FDA UNII

SK3K8V5U78

Created by admin on Wed Apr 02 11:35:20 GMT 2025 , Edited by admin on Wed Apr 02 11:35:20 GMT 2025

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ECHA (EC/EINECS)

255-358-2

Created by admin on Wed Apr 02 11:35:20 GMT 2025 , Edited by admin on Wed Apr 02 11:35:20 GMT 2025

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CAS

41424-11-7

Created by admin on Wed Apr 02 11:35:20 GMT 2025 , Edited by admin on Wed Apr 02 11:35:20 GMT 2025

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PUBCHEM

162465

Created by admin on Wed Apr 02 11:35:20 GMT 2025 , Edited by admin on Wed Apr 02 11:35:20 GMT 2025

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