TRANS-PSEUDOISOEUGENYL 2-METHYLBUTYRATE

U.S. Department of Health & Human Services Divider Arrow

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C15H20O3
Molecular Weight	248.3175
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of TRANS-PSEUDOISOEUGENYL 2-METHYLBUTYRATE

Structure Search

SMILES

CCC(C)C(=O)OC1=CC=C(OC)C=C1\C=C\C

InChI

InChIKey=YARRWVYKHJNVHX-FNORWQNLSA-N

InChI=1S/C15H20O3/c1-5-7-12-10-13(17-4)8-9-14(12)18-15(16)11(3)6-2/h5,7-11H,6H2,1-4H3/b7-5+

HIDE SMILES / InChI

Molecular Formula	C15H20O3
Molecular Weight	248.3175
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	1
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:32:38 GMT 2023` Edited by `admin` on `Sat Dec 16 10:32:38 GMT 2023`
Record UNII	3VEW45M5RZ
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

TRANS-PSEUDOISOEUGENYL 2-METHYLBUTYRATE

Common Name

English

BUTANOIC ACID, 2-METHYL-, 4-METHOXY-2-(1E)-1-PROPEN-1-YLPHENYL ESTER

Systematic Name

English

4-METHOXY-2-(TRANS-1-PROPENYL)PHENYL (±)-2-METHYLBUTANOATE

Systematic Name

English

Code System Code Type Description

RS_ITEM_NUM

1581617

Created by admin on Sat Dec 16 10:32:38 GMT 2023 , Edited by admin on Sat Dec 16 10:32:38 GMT 2023

PRIMARY

FDA UNII

3VEW45M5RZ

Created by admin on Sat Dec 16 10:32:38 GMT 2023 , Edited by admin on Sat Dec 16 10:32:38 GMT 2023

PRIMARY

CAS

58989-20-1

Created by admin on Sat Dec 16 10:32:38 GMT 2023 , Edited by admin on Sat Dec 16 10:32:38 GMT 2023

PRIMARY

PUBCHEM

14056365

Created by admin on Sat Dec 16 10:32:38 GMT 2023 , Edited by admin on Sat Dec 16 10:32:38 GMT 2023

PRIMARY

EPA CompTox

DTXSID20741443

Created by admin on Sat Dec 16 10:32:38 GMT 2023 , Edited by admin on Sat Dec 16 10:32:38 GMT 2023

PRIMARY