U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow 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 .DELTA.-DODECALACTONE

SMILES

CCCCCCCC1CCCC(=O)O1

InChI

InChIKey=QRPLZGZHJABGRS-UHFFFAOYSA-N
InChI=1S/C12H22O2/c1-2-3-4-5-6-8-11-9-7-10-12(13)14-11/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 Fri Dec 15 16:58:35 GMT 2023
Edited
by admin
on Fri Dec 15 16:58:35 GMT 2023
Record UNII
33DIC582TL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.DELTA.-DODECALACTONE
FHFI   MI  
Common Name English
DELTA-DODECALACTONE [FCC]
Common Name English
5-HYDROXYDODECANOIC ACID LACTONE
Common Name English
5-DODECANOLIDE
Common Name English
2H-PYRAN-2-ONE, 6-HEPTYLTETRAHYDRO-
Systematic Name English
5-HYDROXYDODECANOIC ACID
Systematic Name English
.DELTA.-DODECALACTONE [FHFI]
Common Name English
DELTALACTONE
Common Name English
AI 3-36030
Code English
DELTA-DODECALACTONE [HSDB]
Common Name English
DODECANOIC ACID, 5-HYDROXY-, .DELTA.-LACTONE
Common Name English
.DELTA.-DODECALACTONE [MI]
Common Name English
(±)-.DELTA.-DODECALACTONE
Common Name English
6-HEPTYLTETRAHYDRO-2H-PYRAN-2-ONE
Systematic Name English
(R,S)-.DELTA.-DODECALACTONE
Common Name English
FEMA NO. 2401
Code English
.DELTA.-HEPTYL-.DELTA.-VALEROLACTONE
Systematic Name English
.DELTA.-DODECANE LACTONE
Code English
DELTA-DODECALACTONE
FCC   HSDB  
Common Name English
DODECAN-5-OLIDE
Common Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
JECFA EVALUATION DELTA-DODECALACTONE
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
Code System Code Type Description
RXCUI
2371704
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY
MERCK INDEX
m4718
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY Merck Index
HSDB
292
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY
CAS
713-95-1
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY
FDA UNII
33DIC582TL
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY
SMS_ID
100000138728
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY
DAILYMED
33DIC582TL
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY
JECFA MONOGRAPH
46
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY
PUBCHEM
12844
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY
EPA CompTox
DTXSID9047596
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY
ECHA (EC/EINECS)
211-932-4
Created by admin on Fri Dec 15 16:58:36 GMT 2023 , Edited by admin on Fri Dec 15 16:58:36 GMT 2023
PRIMARY