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Details

Stereochemistry MIXED
Molecular Formula C13H22O2
Molecular Weight 210.3126
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NERAL PROPYLENE GLYCOL ACETAL

SMILES

CC1COC(O1)\C=C(\C)CCC=C(C)C

InChI

InChIKey=DWZRENGNFQNWQZ-FLIBITNWSA-N
InChI=1S/C13H22O2/c1-10(2)6-5-7-11(3)8-13-14-9-12(4)15-13/h6,8,12-13H,5,7,9H2,1-4H3/b11-8-

HIDE SMILES / InChI

Molecular Formula C13H22O2
Molecular Weight 210.3126
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:21:48 GMT 2023
Edited
by admin
on Fri Dec 15 19:21:48 GMT 2023
Record UNII
703T1SS7ZU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NERAL PROPYLENE GLYCOL ACETAL
Common Name English
2-((1Z)-2,6-DIMETHYLHEPTA-1,5-DIENYL)-4-METHYL-1,3-DIOXOLANE
Systematic Name English
1,3-DIOXOLANE, 2-((1Z)-2,6-DIMETHYL-1,5-HEPTADIEN-1-YL)-4-METHYL-
Systematic Name English
1,3-DIOXOLANE, 2-(2,6-DIMETHYL-1,5-HEPTADIENYL)-4-METHYL-, (Z)-
Common Name English
2-(2,6-DIMETHYLHEPTA-1,5-DIENYL)-4-METHYL-1,3-DIOXOLANE, (1Z)-
Systematic Name English
Code System Code Type Description
CAS
197718-75-5
Created by admin on Fri Dec 15 19:21:48 GMT 2023 , Edited by admin on Fri Dec 15 19:21:48 GMT 2023
PRIMARY
FDA UNII
703T1SS7ZU
Created by admin on Fri Dec 15 19:21:48 GMT 2023 , Edited by admin on Fri Dec 15 19:21:48 GMT 2023
PRIMARY
PUBCHEM
71587623
Created by admin on Fri Dec 15 19:21:48 GMT 2023 , Edited by admin on Fri Dec 15 19:21:48 GMT 2023
PRIMARY