3-(4-TERT-BUTYLPHENOXY)BENZALDEHYDE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C17H18O2
Molecular Weight	254.3236
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(4-TERT-BUTYLPHENOXY)BENZALDEHYDE

Structure Search

SMILES

CC(C)(C)C1=CC=C(OC2=CC=CC(C=O)=C2)C=C1

InChI

InChIKey=YZIHNHLGGMSWAD-UHFFFAOYSA-N

InChI=1S/C17H18O2/c1-17(2,3)14-7-9-15(10-8-14)19-16-6-4-5-13(11-16)12-18/h4-12H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C17H18O2
Molecular Weight	254.3236
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 `Sat Dec 16 08:02:00 GMT 2023` Edited by `admin` on `Sat Dec 16 08:02:00 GMT 2023`
Record UNII	IW9QVO2DJU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(4-TERT-BUTYLPHENOXY)BENZALDEHYDE

Systematic Name

English

BENZALDEHYDE, 3-(4-(1,1-DIMETHYLETHYL)PHENOXY)-

Systematic Name

English

3-(4-(1,1-DIMETHYLETHYL)PHENOXY)BENZALDEHYDE

Systematic Name

English

J318.037I

Code

English

3-((4-TERT-BUTYLPHENYL)OXY)BENZALDEHYDE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID5022300

Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023

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CAS

69770-23-6

Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023

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PUBCHEM

94653

Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023

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ECHA (EC/EINECS)

274-109-9

Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023

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FDA UNII

IW9QVO2DJU

Created by admin on Sat Dec 16 08:02:00 GMT 2023 , Edited by admin on Sat Dec 16 08:02:00 GMT 2023

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