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Details

Stereochemistry MIXED
Molecular Formula C11H14O2
Molecular Weight 178.2277
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PHENYLACETALDEHYDE PROPYLENE GLYCOL ACETAL

SMILES

CC1COC(CC2=CC=CC=C2)O1

InChI

InChIKey=HVTGPXYNYDWJHK-UHFFFAOYSA-N
InChI=1S/C11H14O2/c1-9-8-12-11(13-9)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3

HIDE SMILES / InChI

Molecular Formula C11H14O2
Molecular Weight 178.2277
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:48:24 GMT 2025
Edited
by admin
on Mon Mar 31 20:48:24 GMT 2025
Record UNII
U5F4U3WMGD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FEMA NO. 4629
Preferred Name English
PHENYLACETALDEHYDE PROPYLENE GLYCOL ACETAL
Common Name English
PHENYLACETALDEHYDE PROPYLENEGLYCOL ACETAL, (±)-
Common Name English
PHENYLACETALDEHYDE PROPYLENEGLYCOL ACETAL
Common Name English
4-METHYL-2-BENZYL-1,3-DIOXOLANE
Systematic Name English
NSC-25477
Code English
2-BENZYL-4-METHYL-1,3-DIOXOLANE
Systematic Name English
(±)-PHENYLACETALDEHYDE PROPYLENEGLYCOL ACETAL
Common Name English
1,3-DIOXOLANE, 4-METHYL-2-(PHENYLMETHYL)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70863548
Created by admin on Mon Mar 31 20:48:24 GMT 2025 , Edited by admin on Mon Mar 31 20:48:24 GMT 2025
PRIMARY
FDA UNII
U5F4U3WMGD
Created by admin on Mon Mar 31 20:48:24 GMT 2025 , Edited by admin on Mon Mar 31 20:48:24 GMT 2025
PRIMARY
ECHA (EC/EINECS)
226-783-0
Created by admin on Mon Mar 31 20:48:24 GMT 2025 , Edited by admin on Mon Mar 31 20:48:24 GMT 2025
PRIMARY
NSC
25477
Created by admin on Mon Mar 31 20:48:24 GMT 2025 , Edited by admin on Mon Mar 31 20:48:24 GMT 2025
PRIMARY
PUBCHEM
95633
Created by admin on Mon Mar 31 20:48:24 GMT 2025 , Edited by admin on Mon Mar 31 20:48:24 GMT 2025
PRIMARY
CAS
5468-05-3
Created by admin on Mon Mar 31 20:48:24 GMT 2025 , Edited by admin on Mon Mar 31 20:48:24 GMT 2025
PRIMARY