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Details

Stereochemistry ACHIRAL
Molecular Formula C13H16O2
Molecular Weight 204.2649
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Phenylpropargyl aldehyde diethyl acetal

SMILES

CCOC(OCC)C#CC1=CC=CC=C1

InChI

InChIKey=DTEGZYXCDQFSBZ-UHFFFAOYSA-N
InChI=1S/C13H16O2/c1-3-14-13(15-4-2)11-10-12-8-6-5-7-9-12/h5-9,13H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C13H16O2
Molecular Weight 204.2649
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 19:16:20 GMT 2025
Edited
by admin
on Tue Apr 01 19:16:20 GMT 2025
Record UNII
UXW9TA64Z8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Phenylpropargyl aldehyde diethyl acetal
Systematic Name English
Dehydrocinnamaldehyde-diethylacetal
Preferred Name English
NSC-66194
Code English
(3,3-Diethoxy-1-propyn-1-yl)benzene
Systematic Name English
Benzene, (3,3-diethoxy-1-propyn-1-yl)-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
228-143-6
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
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FDA UNII
UXW9TA64Z8
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
PRIMARY
EPA CompTox
DTXSID80210362
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
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PUBCHEM
64818
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
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CAS
6142-95-6
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
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NSC
66194
Created by admin on Tue Apr 01 19:16:20 GMT 2025 , Edited by admin on Tue Apr 01 19:16:20 GMT 2025
PRIMARY