5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol

C29H18Br2O — CID 159840837

IUPAC5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol
SMILESOC1(c2ccccc2-c2ccccc2)c2cc(Br)ccc2-c2c1cc(Br)c1ccccc21
InChIInChI=1S/C29H18Br2O/c30-19-14-15-23-25(16-19)29(32,24-13-7-6-10-20(24)18-8-2-1-3-9-18)26-17-27(31)21-11-4-5-12-22(21)28(23)26/h1-17,32H
InChIKeyUAGSECIHCXRQQO-UHFFFAOYSA-N
MW542.27 g/mol
LogP8.30
Rot. Bonds2

About 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol

5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol (PubChem CID 159840837) has the molecular formula C29H18Br2O and a molecular weight of 542.27 g/mol. Its IUPAC name is 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol.

Molecular Properties

Compound Name5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol
PubChem CID159840837
Molecular FormulaC29H18Br2O
Molecular Weight542.27 g/mol
Exact Mass539.97
IUPAC Name5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol
SMILESOC1(c2ccccc2-c2ccccc2)c2cc(Br)ccc2-c2c1cc(Br)c1ccccc21
InChIInChI=1S/C29H18Br2O/c30-19-14-15-23-25(16-19)29(32,24-13-7-6-10-20(24)18-8-2-1-3-9-18)26-17-27(31)21-11-4-5-12-22(21)28(23)26/h1-17,32H
InChIKeyUAGSECIHCXRQQO-UHFFFAOYSA-N
XLogP8.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500542.27
LogP ≤ 58.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-bromo-2-phenylbenzene;5,9-dibromobenzo[c]fluoren-7-one;5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol;5,9-dibromospiro[benzo[c]fluorene-7,9'-fluorene];methane;prop-1-yne
CID 159840836
2-bromo-9-[8-(4-phenylphenyl)naphthalen-1-yl]fluoren-9-ol
CID 164732104
9-bromo-7-(8-phenylnaphthalen-1-yl)benzo[a]phenalen-7-ol
CID 176723096
3-bromo-10,10-dimethyl-9-(2-phenylphenyl)anthracen-9-ol
CID 142567776
5-bromo-9-phenylspiro[benzo[c]fluorene-7,9'-fluorene]
CID 134354213
11-bromo-14-(2-phenanthren-9-ylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-14-ol
CID 130463599
17,24-bis(2-phenylphenyl)hexacyclo[12.12.0.02,7.08,13.016,25.018,23]hexacosa-1(26),2,4,6,8,10,12,14,16(25),18,20,22-dodecaene-17,24-diol
CID 89216058
1-bromo-2-phenylbenzene;9,15-dibromo-23-oxahexacyclo[11.11.0.02,11.03,8.016,24.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15,17,19,21-undecaen-12-one;9,15-dibromo-12-(2-phenylphenyl)-23-oxahexacyclo[11.11.0.02,11.03,8.016,24.017,22]tetracosa-1(24),2(11),3,5,7,9,13,15,17,19,21-undecaen-12-ol;methane
CID 158302770
11-bromo-14-(2-dibenzofuran-3-ylphenyl)tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-14-ol
CID 130463554
9-(2-bromophenyl)-4-phenylfluoren-9-ol
CID 118049400
3-bromo-7-[2-(4-phenylphenyl)phenyl]benzo[b]phenalen-7-ol
CID 164732050
18-bromo-21-[2-(N-phenylanilino)phenyl]pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaen-21-ol
CID 172813495

Frequently Asked Questions

What is the IUPAC name of 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol?
The IUPAC name of 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol (CID 159840837) is 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol.
What is the SMILES notation for 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol?
The canonical SMILES for 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol is OC1(c2ccccc2-c2ccccc2)c2cc(Br)ccc2-c2c1cc(Br)c1ccccc21.
What is the InChIKey of 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol?
The InChIKey is UAGSECIHCXRQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H18Br2O/c30-19-14-15-23-25(16-19)29(32,24-13-7-6-10-20(24)18-8-2-1-3-9-18)26-17-27(31)21-11-4-5-12-22(21)28(23)26/h1-17,32H.
What are the key properties of 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol?
5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol has a molecular weight of 542.27 g/mol, XLogP of 8.30, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,9-dibromo-7-(2-phenylphenyl)benzo[c]fluoren-7-ol is sourced from PubChem (CID 159840837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).