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Details

Stereochemistry ACHIRAL
Molecular Formula C6H9NO2
Molecular Weight 127.1412
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-Dioxolane-2-propanenitrile

SMILES

N#CCCC1OCCO1

InChI

InChIKey=ILNCXUYVDNKISU-UHFFFAOYSA-N
InChI=1S/C6H9NO2/c7-3-1-2-6-8-4-5-9-6/h6H,1-2,4-5H2

HIDE SMILES / InChI

Molecular Formula C6H9NO2
Molecular Weight 127.1412
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:15:48 GMT 2025
Edited
by admin
on Tue Apr 01 19:15:48 GMT 2025
Record UNII
BWS884BV2R
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-Dioxolane-2-propiononitrile
Preferred Name English
1,3-Dioxolane-2-propanenitrile
Systematic Name English
1,3-Dioxolane-2-propionitrile
Systematic Name English
Code System Code Type Description
PUBCHEM
78098
Created by admin on Tue Apr 01 19:15:48 GMT 2025 , Edited by admin on Tue Apr 01 19:15:48 GMT 2025
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CAS
4388-58-3
Created by admin on Tue Apr 01 19:15:48 GMT 2025 , Edited by admin on Tue Apr 01 19:15:48 GMT 2025
PRIMARY
ECHA (EC/EINECS)
224-502-6
Created by admin on Tue Apr 01 19:15:48 GMT 2025 , Edited by admin on Tue Apr 01 19:15:48 GMT 2025
PRIMARY
FDA UNII
BWS884BV2R
Created by admin on Tue Apr 01 19:15:48 GMT 2025 , Edited by admin on Tue Apr 01 19:15:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID10195971
Created by admin on Tue Apr 01 19:15:48 GMT 2025 , Edited by admin on Tue Apr 01 19:15:48 GMT 2025
PRIMARY