U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C16H16O4
Molecular Weight 272.2958
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Anisoin

SMILES

COC1=CC=C(C=C1)C(O)C(=O)C2=CC=C(OC)C=C2

InChI

InChIKey=LRRQSCPPOIUNGX-UHFFFAOYSA-N
InChI=1S/C16H16O4/c1-19-13-7-3-11(4-8-13)15(17)16(18)12-5-9-14(20-2)10-6-12/h3-10,15,17H,1-2H3

HIDE SMILES / InChI

Molecular Formula C16H16O4
Molecular Weight 272.2958
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:46:37 GMT 2023
Edited
by admin
on Sat Dec 16 12:46:37 GMT 2023
Record UNII
KUY567Z2QL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Anisoin
Common Name English
NSC-8504
Code English
(±)-p-Anisoin
Common Name English
4,4′-Dimethoxybenzoin
Common Name English
1,2-Bis(4-methoxyphenyl)-2-hydroxyethanone
Systematic Name English
p,p′-Dimethoxybenzoin
Common Name English
Ethanone, 2-hydroxy-1,2-bis(4-methoxyphenyl)-
Systematic Name English
2-Hydroxy-1,2-bis(4-methoxyphenyl)ethanone
Systematic Name English
1-Oxo-1,2-bis(p-methoxyphenyl)-2-hydroxyethane
Systematic Name English
NSC-7960
Code English
Code System Code Type Description
PUBCHEM
95415
Created by admin on Sat Dec 16 12:46:37 GMT 2023 , Edited by admin on Sat Dec 16 12:46:37 GMT 2023
PRIMARY
FDA UNII
KUY567Z2QL
Created by admin on Sat Dec 16 12:46:37 GMT 2023 , Edited by admin on Sat Dec 16 12:46:37 GMT 2023
PRIMARY
NSC
7960
Created by admin on Sat Dec 16 12:46:37 GMT 2023 , Edited by admin on Sat Dec 16 12:46:37 GMT 2023
PRIMARY
CAS
119-52-8
Created by admin on Sat Dec 16 12:46:37 GMT 2023 , Edited by admin on Sat Dec 16 12:46:37 GMT 2023
PRIMARY
EPA CompTox
DTXSID60883311
Created by admin on Sat Dec 16 12:46:37 GMT 2023 , Edited by admin on Sat Dec 16 12:46:37 GMT 2023
PRIMARY
ECHA (EC/EINECS)
204-330-8
Created by admin on Sat Dec 16 12:46:37 GMT 2023 , Edited by admin on Sat Dec 16 12:46:37 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE