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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H10O2
Molecular Weight 138.1638
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Methylorcinol

SMILES

CC1=CC(O)=CC(O)=C1C

InChI

InChIKey=RCNCKKACINZDOI-UHFFFAOYSA-N
InChI=1S/C8H10O2/c1-5-3-7(9)4-8(10)6(5)2/h3-4,9-10H,1-2H3

HIDE SMILES / InChI

Molecular Formula C8H10O2
Molecular Weight 138.1638
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
28.0 µM [IC50]
Substance Class Chemical
Created
by admin
on Sat Dec 16 19:13:49 GMT 2023
Edited
by admin
on Sat Dec 16 19:13:49 GMT 2023
Record UNII
W3FCQ2N8R4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Methylorcinol
Systematic Name English
1,3-Benzenediol, 4,5-dimethyl-
Systematic Name English
1,2-Dimethyl-3,5-dihydroxybenzene
Systematic Name English
Resorcinol, 4,5-dimethyl-
Systematic Name English
1,3-Dihydroxy-4,5-dimethylbenzene
Systematic Name English
NSC-243682
Code English
3,5-Dihydroxy-1,2-dimethylbenzene
Systematic Name English
4,5-Dimethyl-1,3-dihydroxybenzene
Systematic Name English
4,5-Dimethylbenzene-1,3-diol
Systematic Name English
4,5-Dimethyl-1,3-benzenediol
Systematic Name English
4,5-Dimethylresorcinol
Systematic Name English
Code System Code Type Description
PUBCHEM
10697
Created by admin on Sat Dec 16 19:13:49 GMT 2023 , Edited by admin on Sat Dec 16 19:13:49 GMT 2023
PRIMARY
CAS
527-55-9
Created by admin on Sat Dec 16 19:13:49 GMT 2023 , Edited by admin on Sat Dec 16 19:13:49 GMT 2023
PRIMARY
FDA UNII
W3FCQ2N8R4
Created by admin on Sat Dec 16 19:13:49 GMT 2023 , Edited by admin on Sat Dec 16 19:13:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID40200663
Created by admin on Sat Dec 16 19:13:49 GMT 2023 , Edited by admin on Sat Dec 16 19:13:49 GMT 2023
PRIMARY
NSC
243682
Created by admin on Sat Dec 16 19:13:49 GMT 2023 , Edited by admin on Sat Dec 16 19:13:49 GMT 2023
PRIMARY