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Details

Stereochemistry ACHIRAL
Molecular Formula C11H12O2
Molecular Weight 176.2118
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of P-METHOXY-.ALPHA.-METHYLCINNAMALDEHYDE, (E)-

SMILES

COC1=CC=C(\C=C(/C)C=O)C=C1

InChI

InChIKey=BNBBFUJNMYQYLA-VQHVLOKHSA-N
InChI=1S/C11H12O2/c1-9(8-12)7-10-3-5-11(13-2)6-4-10/h3-8H,1-2H3/b9-7+

HIDE SMILES / InChI

Molecular Formula C11H12O2
Molecular Weight 176.2118
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 20:07:48 GMT 2025
Edited
by admin
on Mon Mar 31 20:07:48 GMT 2025
Record UNII
H1074TK90F
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
P-METHOXY-.ALPHA.-METHYLCINNAMALDEHYDE, (E)-
Common Name English
3-(P-METHOXYPHENYL)-2-METHYL-2-PROPENAL
Preferred Name English
2-((E)-4-METHOXYBENZYLIDENE)PROPAN-1-AL
Systematic Name English
2-PROPENAL, 3-(4-METHOXYPHENYL)-2-METHYL-, (2E)-
Systematic Name English
2-PROPENAL, 3-(4-METHOXYPHENYL)-2-METHYL-, (E)-
Systematic Name English
Code System Code Type Description
CAS
75101-99-4
Created by admin on Mon Mar 31 20:07:48 GMT 2025 , Edited by admin on Mon Mar 31 20:07:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID801255747
Created by admin on Mon Mar 31 20:07:48 GMT 2025 , Edited by admin on Mon Mar 31 20:07:48 GMT 2025
PRIMARY
PUBCHEM
5388696
Created by admin on Mon Mar 31 20:07:48 GMT 2025 , Edited by admin on Mon Mar 31 20:07:48 GMT 2025
PRIMARY
FDA UNII
H1074TK90F
Created by admin on Mon Mar 31 20:07:48 GMT 2025 , Edited by admin on Mon Mar 31 20:07:48 GMT 2025
PRIMARY