4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol

C19H14N2O2 — CID 171384150

IUPAC4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol
SMILESOc1ccc(/N=N/c2ccc3c(c2)-c2ccccc2C3)c(O)c1
InChIInChI=1S/C19H14N2O2/c22-15-7-8-18(19(23)11-15)21-20-14-6-5-13-9-12-3-1-2-4-16(12)17(13)10-14/h1-8,10-11,22-23H,9H2/b21-20+
InChIKeyRYMVQCDBCLKCGI-QZQOTICOSA-N
MW302.33 g/mol
LogP5.08
Rot. Bonds2

About 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol

4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol (PubChem CID 171384150) has the molecular formula C19H14N2O2 and a molecular weight of 302.33 g/mol. Its IUPAC name is 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol.

Molecular Properties

Compound Name4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol
PubChem CID171384150
Molecular FormulaC19H14N2O2
Molecular Weight302.33 g/mol
Exact Mass302.11
IUPAC Name4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol
SMILESOc1ccc(/N=N/c2ccc3c(c2)-c2ccccc2C3)c(O)c1
InChIInChI=1S/C19H14N2O2/c22-15-7-8-18(19(23)11-15)21-20-14-6-5-13-9-12-3-1-2-4-16(12)17(13)10-14/h1-8,10-11,22-23H,9H2/b21-20+
InChIKeyRYMVQCDBCLKCGI-QZQOTICOSA-N
XLogP5.08
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.33
LogP ≤ 55.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol?
The IUPAC name of 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol (CID 171384150) is 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol.
What is the SMILES notation for 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol?
The canonical SMILES for 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol is Oc1ccc(/N=N/c2ccc3c(c2)-c2ccccc2C3)c(O)c1.
What is the InChIKey of 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol?
The InChIKey is RYMVQCDBCLKCGI-QZQOTICOSA-N. The full InChI is InChI=1S/C19H14N2O2/c22-15-7-8-18(19(23)11-15)21-20-14-6-5-13-9-12-3-1-2-4-16(12)17(13)10-14/h1-8,10-11,22-23H,9H2/b21-20+.
What are the key properties of 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol?
4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol has a molecular weight of 302.33 g/mol, XLogP of 5.08, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(9H-fluoren-3-yldiazenyl)benzene-1,3-diol is sourced from PubChem (CID 171384150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).