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Details

Stereochemistry ACHIRAL
Molecular Formula C14H21HgO.C2H3O2
Molecular Weight 464.95
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETOMEROCTOL

SMILES

CC([O-])=O.CC(C)(C)CC(C)(C)C1=CC=C(O)C([Hg+])=C1

InChI

InChIKey=YEWQCWVEXRSMSB-UHFFFAOYSA-M
InChI=1S/C14H21O.C2H4O2.Hg/c1-13(2,3)10-14(4,5)11-6-8-12(15)9-7-11;1-2(3)4;/h6-8,15H,10H2,1-5H3;1H3,(H,3,4);/q;;+1/p-1

HIDE SMILES / InChI

Molecular Formula C14H21HgO
Molecular Weight 405.91
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C2H3O2
Molecular Weight 59.044
Charge -1
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 Fri Dec 15 15:01:23 GMT 2023
Edited
by admin
on Fri Dec 15 15:01:23 GMT 2023
Record UNII
W8OY9Y1132
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACETOMEROCTOL
MI  
Common Name English
ACETOMEROCTOL [MI]
Common Name English
ACETOMERCTOL
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C28394
Created by admin on Fri Dec 15 15:01:23 GMT 2023 , Edited by admin on Fri Dec 15 15:01:23 GMT 2023
Code System Code Type Description
EPA CompTox
DTXSID201047689
Created by admin on Fri Dec 15 15:01:23 GMT 2023 , Edited by admin on Fri Dec 15 15:01:23 GMT 2023
PRIMARY
ECHA (EC/EINECS)
209-534-0
Created by admin on Fri Dec 15 15:01:23 GMT 2023 , Edited by admin on Fri Dec 15 15:01:23 GMT 2023
PRIMARY
NCI_THESAURUS
C77021
Created by admin on Fri Dec 15 15:01:23 GMT 2023 , Edited by admin on Fri Dec 15 15:01:23 GMT 2023
PRIMARY
FDA UNII
W8OY9Y1132
Created by admin on Fri Dec 15 15:01:23 GMT 2023 , Edited by admin on Fri Dec 15 15:01:23 GMT 2023
PRIMARY
MERCK INDEX
m2
Created by admin on Fri Dec 15 15:01:23 GMT 2023 , Edited by admin on Fri Dec 15 15:01:23 GMT 2023
PRIMARY Merck Index
PUBCHEM
16682945
Created by admin on Fri Dec 15 15:01:23 GMT 2023 , Edited by admin on Fri Dec 15 15:01:23 GMT 2023
PRIMARY
CAS
584-18-9
Created by admin on Fri Dec 15 15:01:23 GMT 2023 , Edited by admin on Fri Dec 15 15:01:23 GMT 2023
PRIMARY