5-BUTYL-4-METHYLDIHYDRO-2(3H)-FURANONE, TRANS-

Details

Stereochemistry	RACEMIC
Molecular Formula	C9H16O2
Molecular Weight	156.2221
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-BUTYL-4-METHYLDIHYDRO-2(3H)-FURANONE, TRANS-

Structure Search

SMILES

CCCC[C@H]1OC(=O)C[C@@H]1C

InChI

InChIKey=WNVCMFHPRIBNCW-JGVFFNPUSA-N

InChI=1S/C9H16O2/c1-3-4-5-8-7(2)6-9(10)11-8/h7-8H,3-6H2,1-2H3/t7-,8+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C9H16O2
Molecular Weight	156.2221
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

Title	Date	PubMed
Synthesis and analysis of thio-, thiono-, and dithio-derivatives of whiskey lactone.	2001-12	11743786

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:00:07 GMT 2025` Edited by `admin` on `Mon Mar 31 20:00:07 GMT 2025`
Record UNII	29IPH2W8KP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-BUTYL-4-METHYLDIHYDRO-2(3H)-FURANONE, TRANS-

Systematic Name

English

FEMA NO. 3803, TRANS-

Preferred Name

English

2(3H)-FURANONE, 5-BUTYLDIHYDRO-4-METHYL-, (4R,5S)-REL-

Common Name

English

TRANS-OAKLACTONE

Common Name

English

(±)-TRANS-WHISKEY LACTONE

Common Name

English

TRANS-.BETA.-METHYL-.GAMMA.-OCTALACTONE

Common Name

English

TRANS-3-METHYL-4-OCTANOLIDE

Common Name

English

WHISKEY LACTONE, (E)-

Common Name

English

.BETA.-METHYL-.GAMMA.-OCTALACTONE, TRANS-

Common Name

English

2(3H)-FURANONE, 5-BUTYLDIHYDRO-4-METHYL-, TRANS-

Systematic Name

English

TRANS-4-HYDROXY-3-METHYLOCTANOIC ACID .GAMMA.-LACTONE

Common Name

English

TRANS-WHISKEY LACTONE

Common Name

English

Code System Code Type Description

FDA UNII

29IPH2W8KP

Created by admin on Mon Mar 31 20:00:07 GMT 2025 , Edited by admin on Mon Mar 31 20:00:07 GMT 2025

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CAS

39638-67-0

Created by admin on Mon Mar 31 20:00:07 GMT 2025 , Edited by admin on Mon Mar 31 20:00:07 GMT 2025

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WIKIPEDIA

TRANS-3-METHYL-4-OCTANOLIDE

Created by admin on Mon Mar 31 20:00:07 GMT 2025 , Edited by admin on Mon Mar 31 20:00:07 GMT 2025

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