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Details

Stereochemistry RACEMIC
Molecular Formula C15H13Cl3O3
Molecular Weight 347.621
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2,2,2-TRICHLORO-1-(4-METHOXYPHENYL)ETHYL)-1,2-BENZENEDIOL

SMILES

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

InChI

InChIKey=CFAVOGVJXCIQLR-UHFFFAOYSA-N
InChI=1S/C15H13Cl3O3/c1-21-11-5-2-9(3-6-11)14(15(16,17)18)10-4-7-12(19)13(20)8-10/h2-8,14,19-20H,1H3

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
4-(2,2,2-TRICHLORO-1-(4-METHOXYPHENYL)ETHYL)-1,2-BENZENEDIOL
Systematic Name English
1,2-BENZENEDIOL, 4-(2,2,2-TRICHLORO-1-(4-METHOXYPHENYL)ETHYL)-
Systematic Name English
CATECHOL METHOXYCHLOR
Common Name English
Code System Code Type Description
CAS
159899-72-6
Created by admin on Sat Dec 16 16:41:00 GMT 2023 , Edited by admin on Sat Dec 16 16:41:00 GMT 2023
PRIMARY
FDA UNII
O7WE9AVO29
Created by admin on Sat Dec 16 16:41:00 GMT 2023 , Edited by admin on Sat Dec 16 16:41:00 GMT 2023
PRIMARY
PUBCHEM
86178807
Created by admin on Sat Dec 16 16:41:00 GMT 2023 , Edited by admin on Sat Dec 16 16:41:00 GMT 2023
PRIMARY
PARENT (METABOLITE)
Structure of METHOXYCHLOR
NIH
NCATS
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