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Details

Stereochemistry RACEMIC
Molecular Formula C12H26O3
Molecular Weight 218.333
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HYDROXYCITRONELLAL DIMETHYL ACETAL

SMILES

COC(CC(C)CCCC(C)(C)O)OC

InChI

InChIKey=QCJVKUULZGKQDG-UHFFFAOYSA-N
InChI=1S/C12H26O3/c1-10(9-11(14-4)15-5)7-6-8-12(2,3)13/h10-11,13H,6-9H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C12H26O3
Molecular Weight 218.333
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 20:27:08 GMT 2025
Edited
by admin
on Mon Mar 31 20:27:08 GMT 2025
Record UNII
K989V651N4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDROXYCITRONELLAL DIMETHYL ACETAL
FCC   FHFI  
Systematic Name English
FEMA NO. 2585
Preferred Name English
2-OCTANOL, 8,8-DIMETHOXY-2,6-DIMETHYL-
Systematic Name English
HYDROXYCITRONELLAL DIMETHYL ACETAL [FCC]
Common Name English
8,8-DIMETHOXY-2,6-DIMETHYLOCTAN-2-OL
Systematic Name English
1,1-DIMETHOXY-3,7-DIMETHYL-7-OCTANOL
Systematic Name English
HYDROXYCITRONELLAL DMA
Common Name English
HYDROXYCITRONELLAL DIMETHYL ACETAL [FHFI]
Common Name English
(±)-HYDROXYCITRONELLAL DIMETHYL ACETAL
Systematic Name English
HYDROXYCITRONELLAL DIMETHYL ACETAL, (±)-
Systematic Name English
NSC-76412
Code English
OCTANAL, 7-HYDROXY-3,7-DIMETHYL-, DIMETHYL ACETAL
Common Name English
LAURINE DIMETHYL ACETAL
Common Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Mon Mar 31 20:27:08 GMT 2025 , Edited by admin on Mon Mar 31 20:27:08 GMT 2025
Code System Code Type Description
JECFA MONOGRAPH
467
Created by admin on Mon Mar 31 20:27:08 GMT 2025 , Edited by admin on Mon Mar 31 20:27:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID4047547
Created by admin on Mon Mar 31 20:27:08 GMT 2025 , Edited by admin on Mon Mar 31 20:27:08 GMT 2025
PRIMARY
PUBCHEM
8863
Created by admin on Mon Mar 31 20:27:08 GMT 2025 , Edited by admin on Mon Mar 31 20:27:08 GMT 2025
PRIMARY
CAS
141-92-4
Created by admin on Mon Mar 31 20:27:08 GMT 2025 , Edited by admin on Mon Mar 31 20:27:08 GMT 2025
PRIMARY
ECHA (EC/EINECS)
205-510-9
Created by admin on Mon Mar 31 20:27:08 GMT 2025 , Edited by admin on Mon Mar 31 20:27:08 GMT 2025
PRIMARY
FDA UNII
K989V651N4
Created by admin on Mon Mar 31 20:27:08 GMT 2025 , Edited by admin on Mon Mar 31 20:27:08 GMT 2025
PRIMARY
NSC
76412
Created by admin on Mon Mar 31 20:27:08 GMT 2025 , Edited by admin on Mon Mar 31 20:27:08 GMT 2025
PRIMARY