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Details

Stereochemistry MIXED
Molecular Formula C9H16O3
Molecular Weight 172.2215
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of PENTENYL-1,3-DIOXAN-5-OL, (E)-

SMILES

CCC\C=C\C1OCC(O)CO1

InChI

InChIKey=KFIARNWETLECIZ-SNAWJCMRSA-N
InChI=1S/C9H16O3/c1-2-3-4-5-9-11-6-8(10)7-12-9/h4-5,8-10H,2-3,6-7H2,1H3/b5-4+

HIDE SMILES / InChI

Molecular Formula C9H16O3
Molecular Weight 172.2215
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 02:13:57 GMT 2023
Edited
by admin
on Sat Dec 16 02:13:57 GMT 2023
Record UNII
XY1VG02M50
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PENTENYL-1,3-DIOXAN-5-OL, (E)-
Systematic Name English
FEMA NO. 4273, (E)-DIOXAN-
Code English
1,3-DIOXAN-5-OL, 2-(1E)-1-PENTEN-1-YL-
Systematic Name English
1,3-DIOXAN-5-OL, 2-(1E)-1-PENTENYL-
Systematic Name English
Code System Code Type Description
FDA UNII
XY1VG02M50
Created by admin on Sat Dec 16 02:13:57 GMT 2023 , Edited by admin on Sat Dec 16 02:13:57 GMT 2023
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PUBCHEM
71587851
Created by admin on Sat Dec 16 02:13:57 GMT 2023 , Edited by admin on Sat Dec 16 02:13:57 GMT 2023
PRIMARY
CAS
897672-50-3
Created by admin on Sat Dec 16 02:13:57 GMT 2023 , Edited by admin on Sat Dec 16 02:13:57 GMT 2023
PRIMARY
EPA CompTox
DTXSID50237884
Created by admin on Sat Dec 16 02:13:57 GMT 2023 , Edited by admin on Sat Dec 16 02:13:57 GMT 2023
PRIMARY