O-(ISOPENTYLOXY)ANISOLE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H18O2
Molecular Weight	194.2701
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of O-(ISOPENTYLOXY)ANISOLE

Structure Search

SMILES

COC1=CC=CC=C1OCCC(C)C

InChI

InChIKey=XKBYPOKPAZUNSO-UHFFFAOYSA-N

InChI=1S/C12H18O2/c1-10(2)8-9-14-12-7-5-4-6-11(12)13-3/h4-7,10H,8-9H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C12H18O2
Molecular Weight	194.2701
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 17:27:10 GMT 2025` Edited by `admin` on `Tue Apr 01 17:27:10 GMT 2025`
Record UNII	8T38VD22J7
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1-METHOXY-2-(3-METHYLBUTOXY)BENZENE

Preferred Name

English

O-(ISOPENTYLOXY)ANISOLE

Systematic Name

English

BENZENE, 1-METHOXY-2-(3-METHYLBUTOXY)-

Systematic Name

English

Code System Code Type Description

FDA UNII

8T38VD22J7

Created by admin on Tue Apr 01 17:27:10 GMT 2025 , Edited by admin on Tue Apr 01 17:27:10 GMT 2025

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EPA CompTox

DTXSID80241393

Created by admin on Tue Apr 01 17:27:10 GMT 2025 , Edited by admin on Tue Apr 01 17:27:10 GMT 2025

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PUBCHEM

3024272

Created by admin on Tue Apr 01 17:27:10 GMT 2025 , Edited by admin on Tue Apr 01 17:27:10 GMT 2025

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ECHA (EC/EINECS)

304-873-1

Created by admin on Tue Apr 01 17:27:10 GMT 2025 , Edited by admin on Tue Apr 01 17:27:10 GMT 2025

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CHEMBL

2252456

Created by admin on Tue Apr 01 17:27:10 GMT 2025 , Edited by admin on Tue Apr 01 17:27:10 GMT 2025

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CAS

94291-49-3

Created by admin on Tue Apr 01 17:27:10 GMT 2025 , Edited by admin on Tue Apr 01 17:27:10 GMT 2025

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