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Details

Stereochemistry MIXED
Molecular Formula C10H20O2
Molecular Weight 172.2646
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETALDEHYDE 1,3-OCTANEDIOL ACETAL

SMILES

CCCCCC1CCOC(C)O1

InChI

InChIKey=NZTUUEJEMACERX-UHFFFAOYSA-N
InChI=1S/C10H20O2/c1-3-4-5-6-10-7-8-11-9(2)12-10/h9-10H,3-8H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H20O2
Molecular Weight 172.2646
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:19:12 GMT 2023
Edited
by admin
on Fri Dec 15 19:19:12 GMT 2023
Record UNII
V0W9UH6J00
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACETALDEHYDE 1,3-OCTANEDIOL ACETAL
FHFI  
Common Name English
2-METHYL-4-PENTYL-1,3-DIOXANE
Systematic Name English
ACETALDEHYDE 1,3-OCTANEDIOL ACETAL, (±)-
Common Name English
(±)-ACETALDEHYDE 1,3-OCTANEDIOL ACETAL
Common Name English
ACETALDEHYDE 1,3-OCTANEDIOL ACETAL [FHFI]
Common Name English
1,3-DIOXANE, 2-METHYL-4-PENTYL-
Systematic Name English
FEMA NO. 4376
Code English
Code System Code Type Description
JECFA MONOGRAPH
1727
Created by admin on Fri Dec 15 19:19:12 GMT 2023 , Edited by admin on Fri Dec 15 19:19:12 GMT 2023
PRIMARY
FDA UNII
V0W9UH6J00
Created by admin on Fri Dec 15 19:19:12 GMT 2023 , Edited by admin on Fri Dec 15 19:19:12 GMT 2023
PRIMARY
EPA CompTox
DTXSID50942300
Created by admin on Fri Dec 15 19:19:12 GMT 2023 , Edited by admin on Fri Dec 15 19:19:12 GMT 2023
PRIMARY
CAS
202188-43-0
Created by admin on Fri Dec 15 19:19:12 GMT 2023 , Edited by admin on Fri Dec 15 19:19:12 GMT 2023
PRIMARY
PUBCHEM
11105826
Created by admin on Fri Dec 15 19:19:12 GMT 2023 , Edited by admin on Fri Dec 15 19:19:12 GMT 2023
PRIMARY