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

Details

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

SHOW SMILES / InChI
Structure of 5-METHOXY-2-TETRALONE

SMILES

COC1=C2CCC(=O)CC2=CC=C1

InChI

InChIKey=MDAIAXRTLTVEOU-UHFFFAOYSA-N
InChI=1S/C11H12O2/c1-13-11-4-2-3-8-7-9(12)5-6-10(8)11/h2-4H,5-7H2,1H3

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 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:01:36 UTC 2023
Edited
by admin
on Sat Dec 16 11:01:36 UTC 2023
Record UNII
V6V2G5MZ9D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-METHOXY-2-TETRALONE
Common Name English
NSC-88880
Code English
2-OXO-5-METHOXY-1,2,3,4-TETRAHYDRONAPHTHALENE
Common Name English
5-METHOXYTETRALIN-2-ONE
Common Name English
5-METHOXY-.BETA.-TETRALONE
Common Name English
2(1H)-NAPHTHALENONE, 3,4-DIHYDRO-5-METHOXY-
Systematic Name English
Code System Code Type Description
NSC
88880
Created by admin on Sat Dec 16 11:01:36 UTC 2023 , Edited by admin on Sat Dec 16 11:01:36 UTC 2023
PRIMARY
PUBCHEM
259194
Created by admin on Sat Dec 16 11:01:36 UTC 2023 , Edited by admin on Sat Dec 16 11:01:36 UTC 2023
PRIMARY
FDA UNII
V6V2G5MZ9D
Created by admin on Sat Dec 16 11:01:36 UTC 2023 , Edited by admin on Sat Dec 16 11:01:36 UTC 2023
PRIMARY
EPA CompTox
DTXSID20293356
Created by admin on Sat Dec 16 11:01:36 UTC 2023 , Edited by admin on Sat Dec 16 11:01:36 UTC 2023
PRIMARY
CAS
32940-15-1
Created by admin on Sat Dec 16 11:01:36 UTC 2023 , Edited by admin on Sat Dec 16 11:01:36 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY