(2,5-DIMETHYLOXAN-2-YL)METHYL ACETATE

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

National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	MIXED
Molecular Formula	C10H18O3
Molecular Weight	186.2481
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (2,5-DIMETHYLOXAN-2-YL)METHYL ACETATE

Structure Search

SMILES

CC1CCC(C)(COC(C)=O)OC1

InChI

InChIKey=WUJUWGCPLYEOOS-UHFFFAOYSA-N

InChI=1S/C10H18O3/c1-8-4-5-10(3,13-6-8)7-12-9(2)11/h8H,4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C10H18O3
Molecular Weight	186.2481
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:07:46 GMT 2025` Edited by `admin` on `Wed Apr 02 11:07:46 GMT 2025`
Record UNII	A9Q5K4Y5AF
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-84206

Preferred Name

English

(2,5-DIMETHYLOXAN-2-YL)METHYL ACETATE

Systematic Name

English

2H-PYRAN-2-METHANOL, TETRAHYDRO-2,5-DIMETHYL-, ACETATE

Systematic Name

English

2H-PYRAN-2-METHANOL, TETRAHYDRO-2,5-DIMETHYL-, 2-ACETATE

Systematic Name

English

Code System Code Type Description

PUBCHEM

256817

Created by admin on Wed Apr 02 11:07:46 GMT 2025 , Edited by admin on Wed Apr 02 11:07:46 GMT 2025

PRIMARY

EPA CompTox

DTXSID701005884

Created by admin on Wed Apr 02 11:07:46 GMT 2025 , Edited by admin on Wed Apr 02 11:07:46 GMT 2025

PRIMARY

CAS

85392-31-0

Created by admin on Wed Apr 02 11:07:46 GMT 2025 , Edited by admin on Wed Apr 02 11:07:46 GMT 2025

PRIMARY

NSC

84206

Created by admin on Wed Apr 02 11:07:46 GMT 2025 , Edited by admin on Wed Apr 02 11:07:46 GMT 2025

PRIMARY

FDA UNII

A9Q5K4Y5AF

Created by admin on Wed Apr 02 11:07:46 GMT 2025 , Edited by admin on Wed Apr 02 11:07:46 GMT 2025

PRIMARY