9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol

C34H27ClO — CID 155408909

IUPAC9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol
SMILESCC1(C)c2ccccc2C(O)(c2ccccc2-c2ccccc2Cl)c2ccc(-c3ccccc3)cc21
InChIInChI=1S/C34H27ClO/c1-33(2)28-17-9-10-18-29(28)34(36,27-16-8-6-14-25(27)26-15-7-11-19-32(26)35)30-21-20-24(22-31(30)33)23-12-4-3-5-13-23/h3-22,36H,1-2H3
InChIKeyMPVNZBXCYUCCPE-UHFFFAOYSA-N
MW487.04 g/mol
LogP8.60
Rot. Bonds3

About 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol

9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol (PubChem CID 155408909) has the molecular formula C34H27ClO and a molecular weight of 487.04 g/mol. Its IUPAC name is 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol.

Molecular Properties

Compound Name9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol
PubChem CID155408909
Molecular FormulaC34H27ClO
Molecular Weight487.04 g/mol
Exact Mass486.18
IUPAC Name9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol
SMILESCC1(C)c2ccccc2C(O)(c2ccccc2-c2ccccc2Cl)c2ccc(-c3ccccc3)cc21
InChIInChI=1S/C34H27ClO/c1-33(2)28-17-9-10-18-29(28)34(36,27-16-8-6-14-25(27)26-15-7-11-19-32(26)35)30-21-20-24(22-31(30)33)23-12-4-3-5-13-23/h3-22,36H,1-2H3
InChIKeyMPVNZBXCYUCCPE-UHFFFAOYSA-N
XLogP8.60
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500487.04
LogP ≤ 58.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

9,9,10,10-tetramethyl-2,6-bis(2-phenylphenyl)anthracene
CID 59649045
3-bromo-10,10-dimethyl-9-(2-phenylphenyl)anthracen-9-ol
CID 142567776
2-[4-[4-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]phenyl]phenyl]-9,9-dimethyl-7-(2-phenylphenyl)fluorene
CID 58880971
2-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 146495829
9-[2-(4-chlorophenyl)phenyl]-2,7-bis(3-phenylphenyl)fluoren-9-ol
CID 155407363
2-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]-7-[9,9-dimethyl-7-(3-phenylphenyl)fluoren-2-yl]-9,9-dimethylfluorene
CID 58881198
2-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]-7-(2,5-diphenylphenyl)-9,9-dimethylfluorene
CID 58881189
3-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)-N-(4-phenylphenyl)-N-[4-(2-phenylphenyl)phenyl]aniline
CID 167176335
2-[2-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)phenyl]-4,6-bis(3-phenylphenyl)-1,3,5-triazine
CID 166996046
2,7-bis(3,5-diphenylphenyl)-9,9-dimethylfluorene
CID 59217114
2-(3,5-diphenylphenyl)-7-[4-[7-(3,5-diphenylphenyl)-9,9-dimethylfluoren-2-yl]phenyl]-9,9-dimethylfluorene
CID 58880913
4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2-yl)pyridine
CID 146495231

Frequently Asked Questions

What is the IUPAC name of 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol?
The IUPAC name of 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol (CID 155408909) is 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol.
What is the SMILES notation for 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol?
The canonical SMILES for 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol is CC1(C)c2ccccc2C(O)(c2ccccc2-c2ccccc2Cl)c2ccc(-c3ccccc3)cc21.
What is the InChIKey of 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol?
The InChIKey is MPVNZBXCYUCCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H27ClO/c1-33(2)28-17-9-10-18-29(28)34(36,27-16-8-6-14-25(27)26-15-7-11-19-32(26)35)30-21-20-24(22-31(30)33)23-12-4-3-5-13-23/h3-22,36H,1-2H3.
What are the key properties of 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol?
9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol has a molecular weight of 487.04 g/mol, XLogP of 8.60, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[2-(2-chlorophenyl)phenyl]-10,10-dimethyl-3-phenylanthracen-9-ol is sourced from PubChem (CID 155408909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).