2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol

C25H16Br2O2 — CID 23496560

IUPAC2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol
SMILESOc1ccc(C2(c3ccc(O)c(Br)c3)c3ccccc3-c3ccccc32)cc1Br
InChIInChI=1S/C25H16Br2O2/c26-21-13-15(9-11-23(21)28)25(16-10-12-24(29)22(27)14-16)19-7-3-1-5-17(19)18-6-2-4-8-20(18)25/h1-14,28-29H
InChIKeyZKTNABJAOZQJCM-UHFFFAOYSA-N
MW508.21 g/mol
LogP6.99
Rot. Bonds2

About 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol

2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol (PubChem CID 23496560) has the molecular formula C25H16Br2O2 and a molecular weight of 508.21 g/mol. Its IUPAC name is 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol.

Molecular Properties

Compound Name2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol
PubChem CID23496560
Molecular FormulaC25H16Br2O2
Molecular Weight508.21 g/mol
Exact Mass505.95
IUPAC Name2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol
SMILESOc1ccc(C2(c3ccc(O)c(Br)c3)c3ccccc3-c3ccccc32)cc1Br
InChIInChI=1S/C25H16Br2O2/c26-21-13-15(9-11-23(21)28)25(16-10-12-24(29)22(27)14-16)19-7-3-1-5-17(19)18-6-2-4-8-20(18)25/h1-14,28-29H
InChIKeyZKTNABJAOZQJCM-UHFFFAOYSA-N
XLogP6.99
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500508.21
LogP ≤ 56.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[9-[4-hydroxy-3-(trifluoromethyl)phenyl]fluoren-9-yl]-2-(trifluoromethyl)phenol
CID 87557614
4-[9-(4-amino-3,5-dibromophenyl)fluoren-9-yl]-2,6-dibromoaniline
CID 141181007
4-[9-(4-amino-3-bromophenyl)fluoren-9-yl]-2-bromoaniline;4-[9-(4-amino-3-chlorophenyl)fluoren-9-yl]-2-chloroaniline
CID 158411353
3-[9-[3-[9-(3-hydroxyphenyl)fluoren-9-yl]phenyl]fluoren-9-yl]phenol
CID 90136304
2-butyl-4-[9-(3-butyl-4-hydroxyphenyl)fluoren-9-yl]phenol
CID 18410576
anthracene-9,10-dione;10,10-bis(3-bromo-4-hydroxy-5-methylphenyl)anthracen-9-one;10,10-bis(3-bromo-4-hydroxyphenyl)anthracen-9-one;10,10-bis(3,5-dibromo-4-hydroxyphenyl)anthracen-9-one;10,10-bis(4-hydroxy-3-methylphenyl)anthracen-9-one;carbanide;2,6-dimethylphenol;iodoform;vanadium
CID 163954284
2-[9-(2-hydroxyphenyl)fluoren-9-yl]phenol
CID 14438476
4-(2-bromo-9-phenylfluoren-9-yl)phenol
CID 146438862
9-(4-amino-3-methylphenyl)-9-(4-hydroxy-3-methylphenyl)fluoren-2-ol
CID 144931267
4-[9-[4-[4-[9-[4-hydroxy-3-(hydroxymethyl)phenyl]fluoren-9-yl]phenyl]phenyl]fluoren-9-yl]benzene-1,2-diol
CID 170225979
4-[9-(4-hydroxy-3-methylphenyl)fluoren-9-yl]-2,3-dimethylphenol
CID 71231529
2-(9-anthracen-2-ylfluoren-9-yl)anthracene
CID 162705610

Frequently Asked Questions

What is the IUPAC name of 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol?
The IUPAC name of 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol (CID 23496560) is 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol.
What is the SMILES notation for 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol?
The canonical SMILES for 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol is Oc1ccc(C2(c3ccc(O)c(Br)c3)c3ccccc3-c3ccccc32)cc1Br.
What is the InChIKey of 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol?
The InChIKey is ZKTNABJAOZQJCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H16Br2O2/c26-21-13-15(9-11-23(21)28)25(16-10-12-24(29)22(27)14-16)19-7-3-1-5-17(19)18-6-2-4-8-20(18)25/h1-14,28-29H.
What are the key properties of 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol?
2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol has a molecular weight of 508.21 g/mol, XLogP of 6.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-4-[9-(3-bromo-4-hydroxyphenyl)fluoren-9-yl]phenol is sourced from PubChem (CID 23496560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).