3-HEPTYLTETRAHYDRO-2H-PYRAN-2-ONE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C12H22O2
Molecular Weight	198.3019
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-HEPTYLTETRAHYDRO-2H-PYRAN-2-ONE

Structure Search

SMILES

CCCCCCCC1CCCOC1=O

InChI

InChIKey=ZJILLWFVFFEWCR-UHFFFAOYSA-N

InChI=1S/C12H22O2/c1-2-3-4-5-6-8-11-9-7-10-14-12(11)13/h11H,2-10H2,1H3

HIDE SMILES / InChI

Molecular Formula	C12H22O2
Molecular Weight	198.3019
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:14:17 GMT 2025` Edited by `admin` on `Mon Mar 31 23:14:17 GMT 2025`
Record UNII	8UB9K2X1FL
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

.ALPHA.-HEPTYL-.DELTA.-VALEROLACTONE

Preferred Name

English

3-HEPTYLTETRAHYDRO-2H-PYRAN-2-ONE

Systematic Name

English

2H-PYRAN-2-ONE, 3-HEPTYLTETRAHYDRO-

Systematic Name

English

Code System Code Type Description

FDA UNII

8UB9K2X1FL

Created by admin on Mon Mar 31 23:14:17 GMT 2025 , Edited by admin on Mon Mar 31 23:14:17 GMT 2025

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EPA CompTox

DTXSID80975141

Created by admin on Mon Mar 31 23:14:17 GMT 2025 , Edited by admin on Mon Mar 31 23:14:17 GMT 2025

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CAS

59726-51-1

Created by admin on Mon Mar 31 23:14:17 GMT 2025 , Edited by admin on Mon Mar 31 23:14:17 GMT 2025

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ECHA (EC/EINECS)

261-889-0

Created by admin on Mon Mar 31 23:14:17 GMT 2025 , Edited by admin on Mon Mar 31 23:14:17 GMT 2025

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PUBCHEM

108382

Created by admin on Mon Mar 31 23:14:17 GMT 2025 , Edited by admin on Mon Mar 31 23:14:17 GMT 2025

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