2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol

C29H19ClO — CID 134194053

IUPAC2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol
SMILESOC1(c2ccccc2-c2ccccc2)c2cc(Cl)ccc2-c2cc3ccccc3cc21
InChIInChI=1S/C29H19ClO/c30-22-14-15-24-25-16-20-10-4-5-11-21(20)17-27(25)29(31,28(24)18-22)26-13-7-6-12-23(26)19-8-2-1-3-9-19/h1-18,31H
InChIKeyPHRDXZRPABJIIW-UHFFFAOYSA-N
MW418.92 g/mol
LogP7.42
Rot. Bonds2

About 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol

2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol (PubChem CID 134194053) has the molecular formula C29H19ClO and a molecular weight of 418.92 g/mol. Its IUPAC name is 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol.

Molecular Properties

Compound Name2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol
PubChem CID134194053
Molecular FormulaC29H19ClO
Molecular Weight418.92 g/mol
Exact Mass418.11
IUPAC Name2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol
SMILESOC1(c2ccccc2-c2ccccc2)c2cc(Cl)ccc2-c2cc3ccccc3cc21
InChIInChI=1S/C29H19ClO/c30-22-14-15-24-25-16-20-10-4-5-11-21(20)17-27(25)29(31,28(24)18-22)26-13-7-6-12-23(26)19-8-2-1-3-9-19/h1-18,31H
InChIKeyPHRDXZRPABJIIW-UHFFFAOYSA-N
XLogP7.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.92
LogP ≤ 57.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol?
The IUPAC name of 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol (CID 134194053) is 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol.
What is the SMILES notation for 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol?
The canonical SMILES for 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol is OC1(c2ccccc2-c2ccccc2)c2cc(Cl)ccc2-c2cc3ccccc3cc21.
What is the InChIKey of 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol?
The InChIKey is PHRDXZRPABJIIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H19ClO/c30-22-14-15-24-25-16-20-10-4-5-11-21(20)17-27(25)29(31,28(24)18-22)26-13-7-6-12-23(26)19-8-2-1-3-9-19/h1-18,31H.
What are the key properties of 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol?
2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol has a molecular weight of 418.92 g/mol, XLogP of 7.42, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-11-(2-phenylphenyl)benzo[b]fluoren-11-ol is sourced from PubChem (CID 134194053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).