Molecular Identity
Chlorotrianisene
1-[1-chloro-2,2-bis(4-methoxyphenyl)ethenyl]-4-methoxybenzene
PubChem CID: 11289
Chlorotrianisene can cause cancer according to state or federal government labeling requirements.
2D Structure
Properties
C23H21ClO3
Molecular Formula
380.90
Molecular Weight
g/mol
380.1179
Exact Mass
Da
6.4
XLogP
Above Lipinski threshold
27.7
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
3
H-Bond Acceptors
442
Complexity
SMILES
Canonical SMILES
SMILES: COC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)OC)Cl)C3=CC=C(C=C3)OCIsomeric SMILES
SMILES: COC1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)OC)Cl)C3=CC=C(C=C3)OCSynonyms(20)
chlorotrianisene569-57-3ChlortrianizenChlortrianisestrolChlortrianisenTACEChlorotrianisineChlorestroloChlorotrianizenChloortrianisestrolKhlortrianizenClorotrisinHormoniseneClorestroloMerbentul
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Chlorotrianisene
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