2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol

C20H15F3O4 — CID 67228250

IUPAC2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol
SMILESCOc1cc2c(O)cc3c(c2cc1OC)-c1ccccc1C3(O)C(F)(F)F
InChIInChI=1S/C20H15F3O4/c1-26-16-7-11-12(8-17(16)27-2)18-10-5-3-4-6-13(10)19(25,20(21,22)23)14(18)9-15(11)24/h3-9,24-25H,1-2H3
InChIKeyDKWDSINGBYQMGA-UHFFFAOYSA-N
MW376.33 g/mol
LogP4.34
Rot. Bonds2

About 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol

2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol (PubChem CID 67228250) has the molecular formula C20H15F3O4 and a molecular weight of 376.33 g/mol. Its IUPAC name is 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol.

Molecular Properties

Compound Name2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol
PubChem CID67228250
Molecular FormulaC20H15F3O4
Molecular Weight376.33 g/mol
Exact Mass376.09
IUPAC Name2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol
SMILESCOc1cc2c(O)cc3c(c2cc1OC)-c1ccccc1C3(O)C(F)(F)F
InChIInChI=1S/C20H15F3O4/c1-26-16-7-11-12(8-17(16)27-2)18-10-5-3-4-6-13(10)19(25,20(21,22)23)14(18)9-15(11)24/h3-9,24-25H,1-2H3
InChIKeyDKWDSINGBYQMGA-UHFFFAOYSA-N
XLogP4.34
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.33
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

7,7-diethyl-2,3-dimethoxybenzo[c]fluoren-5-ol
CID 170317987
7-ethyl-3-methoxybenzo[c]fluorene-5,7-diol
CID 68850071
5-hydroxy-2,3-dimethoxy-7H-benzo[c]fluorene-7-carbaldehyde
CID 175005782
7-butyl-3-methoxy-2-morpholin-4-ylbenzo[c]fluorene-5,7-diol
CID 68841390
2,3-dimethoxy-1',1',5',5'-tetramethyl-9-phenylspiro[benzo[c]fluorene-7,3'-cyclohexane]-5-ol
CID 161242797
2,3-dimethoxy-7-methylnaphtho[2,1-b][1]benziodol-5-ol
CID 163890616
1',1',5',5',16,18-hexamethyl-17,17-bis(trifluoromethyl)spiro[16,18-diazapentacyclo[11.7.0.02,10.03,8.015,19]icosa-1(20),2(10),3,5,7,11,13,15(19)-octaene-9,3'-cyclohexane]-12-ol
CID 89115194
methyl 9-hydroxy-9-(trifluoromethyl)fluorene-3-carboxylate
CID 59492606
4-bromo-9-(trifluoromethyl)fluoren-9-ol
CID 59493116
4-prop-1-en-2-yl-9-(trifluoromethyl)fluoren-9-ol
CID 59492630
4-chloro-2-phenyl-9-(trifluoromethyl)fluoren-9-ol
CID 70902688
1-[4-bromo-9-hydroxy-9-(trifluoromethyl)fluoren-2-yl]oxybutan-2-one
CID 159298887

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol?
The IUPAC name of 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol (CID 67228250) is 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol.
What is the SMILES notation for 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol?
The canonical SMILES for 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol is COc1cc2c(O)cc3c(c2cc1OC)-c1ccccc1C3(O)C(F)(F)F.
What is the InChIKey of 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol?
The InChIKey is DKWDSINGBYQMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F3O4/c1-26-16-7-11-12(8-17(16)27-2)18-10-5-3-4-6-13(10)19(25,20(21,22)23)14(18)9-15(11)24/h3-9,24-25H,1-2H3.
What are the key properties of 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol?
2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol has a molecular weight of 376.33 g/mol, XLogP of 4.34, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-7-(trifluoromethyl)benzo[c]fluorene-5,7-diol is sourced from PubChem (CID 67228250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).