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Details

Stereochemistry ABSOLUTE
Molecular Formula C12H14O2
Molecular Weight 190.2384
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CINNAMALDEHYDE PROPYLENEGLYCOL ACETAL, (2S,4R)-

SMILES

C[C@@H]1CO[C@@H](O1)\C=C\C2=CC=CC=C2

InChI

InChIKey=MQLAQZSLFAOEAK-XEEGDWHKSA-N
InChI=1S/C12H14O2/c1-10-9-13-12(14-10)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3/b8-7+/t10-,12+/m1/s1

HIDE SMILES / InChI

Molecular Formula C12H14O2
Molecular Weight 190.2384
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 00:08:16 GMT 2023
Edited
by admin
on Sat Dec 16 00:08:16 GMT 2023
Record UNII
954806V371
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CINNAMALDEHYDE PROPYLENEGLYCOL ACETAL, (2S,4R)-
Common Name English
FEMA NO. 4596, (2S,4R)-
Code English
(2S,4R)-4-METHYL-2-((E)-STYRYL)-1,3-DIOXOLANE
Systematic Name English
1,3-DIOXOLANE, 4-METHYL-2-(2-PHENYLETHENYL)-, (2S,4R)-
Systematic Name English
Code System Code Type Description
PUBCHEM
71587854
Created by admin on Sat Dec 16 00:08:16 GMT 2023 , Edited by admin on Sat Dec 16 00:08:16 GMT 2023
PRIMARY
CAS
908013-52-5
Created by admin on Sat Dec 16 00:08:16 GMT 2023 , Edited by admin on Sat Dec 16 00:08:16 GMT 2023
PRIMARY
FDA UNII
954806V371
Created by admin on Sat Dec 16 00:08:16 GMT 2023 , Edited by admin on Sat Dec 16 00:08:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID00238265
Created by admin on Sat Dec 16 00:08:16 GMT 2023 , Edited by admin on Sat Dec 16 00:08:16 GMT 2023
PRIMARY