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

Details

Stereochemistry ACHIRAL
Molecular Formula C18H16O2
Molecular Weight 264.3184
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-tert-Butylanthraquinone

SMILES

CC(C)(C)C1=CC=C2C(=O)C3=C(C=CC=C3)C(=O)C2=C1

InChI

InChIKey=YTPSFXZMJKMUJE-UHFFFAOYSA-N
InChI=1S/C18H16O2/c1-18(2,3)11-8-9-14-15(10-11)17(20)13-7-5-4-6-12(13)16(14)19/h4-10H,1-3H3

HIDE SMILES / InChI

Molecular Formula C18H16O2
Molecular Weight 264.3184
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 12:21:57 GMT 2023
Edited
by admin
on Sat Dec 16 12:21:57 GMT 2023
Record UNII
6D4HUF2LSS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-tert-Butylanthraquinone
Systematic Name English
9,10-Anthracenedione, 2-(1,1-dimethylethyl)-
Systematic Name English
NSC-30548
Code English
2-(1,1-Dimethylethyl)-9,10-anthracenedione
Systematic Name English
Code System Code Type Description
PUBCHEM
66532
Created by admin on Sat Dec 16 12:21:57 GMT 2023 , Edited by admin on Sat Dec 16 12:21:57 GMT 2023
PRIMARY
FDA UNII
6D4HUF2LSS
Created by admin on Sat Dec 16 12:21:57 GMT 2023 , Edited by admin on Sat Dec 16 12:21:57 GMT 2023
PRIMARY
CAS
84-47-9
Created by admin on Sat Dec 16 12:21:57 GMT 2023 , Edited by admin on Sat Dec 16 12:21:57 GMT 2023
PRIMARY
ECHA (EC/EINECS)
201-531-2
Created by admin on Sat Dec 16 12:21:57 GMT 2023 , Edited by admin on Sat Dec 16 12:21:57 GMT 2023
PRIMARY
NSC
30548
Created by admin on Sat Dec 16 12:21:57 GMT 2023 , Edited by admin on Sat Dec 16 12:21:57 GMT 2023
PRIMARY
EPA CompTox
DTXSID3058903
Created by admin on Sat Dec 16 12:21:57 GMT 2023 , Edited by admin on Sat Dec 16 12:21:57 GMT 2023
PRIMARY