9,10-dihydroxyanthracene-1-diazonium

C14H9N2O2+ — CID 90949542

IUPAC9,10-dihydroxyanthracene-1-diazonium
SMILESN#[N+]c1cccc2c(O)c3ccccc3c(O)c12
InChIInChI=1S/C14H8N2O2/c15-16-11-7-3-6-10-12(11)14(18)9-5-2-1-4-8(9)13(10)17/h1-7,15H/p+1
InChIKeySSASYCDOBAXKNW-UHFFFAOYSA-O
MW237.24 g/mol
LogP3.89
Rot. Bonds

About 9,10-dihydroxyanthracene-1-diazonium

9,10-dihydroxyanthracene-1-diazonium (PubChem CID 90949542) has the molecular formula C14H9N2O2+ and a molecular weight of 237.24 g/mol. Its IUPAC name is 9,10-dihydroxyanthracene-1-diazonium.

Molecular Properties

Compound Name9,10-dihydroxyanthracene-1-diazonium
PubChem CID90949542
Molecular FormulaC14H9N2O2+
Molecular Weight237.24 g/mol
Exact Mass237.07
IUPAC Name9,10-dihydroxyanthracene-1-diazonium
SMILESN#[N+]c1cccc2c(O)c3ccccc3c(O)c12
InChIInChI=1S/C14H8N2O2/c15-16-11-7-3-6-10-12(11)14(18)9-5-2-1-4-8(9)13(10)17/h1-7,15H/p+1
InChIKeySSASYCDOBAXKNW-UHFFFAOYSA-O
XLogP3.89
TPSA68.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.24
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

dibenzothiophene-1-diazonium
CID 71331695
benzene-1,2-didiazonium
CID 22568635
anthracene-1,5,9,10-tetrol
CID 71371518
pyrene-4,5,9,10-tetrol
CID 144772301
anthra[1,2-c]diazete-5,10-diol
CID 136503832
sodium 3-diazonio-4-hydroxynaphthalene-1-sulfonate
CID 23707139
2-chloro-10-hydroxyanthracene-9-diazonium
CID 20536808
6-diazonio-5-hydroxynaphthalene-1-sulfinate
CID 97049891
anthracene-1,4,5,9,10-pentol
CID 14166820
tetracyclo[6.6.2.02,7.09,14]hexadeca-1(15),2,4,6,8(16),9,11,13-octaene-15,16-diol
CID 123414874
2-(2-diazoniophenyl)acetate
CID 172717003
1,2,3,4-tetrahydronaphtho[3,2-f]quinoxaline-7,12-diol
CID 123973676

Frequently Asked Questions

What is the IUPAC name of 9,10-dihydroxyanthracene-1-diazonium?
The IUPAC name of 9,10-dihydroxyanthracene-1-diazonium (CID 90949542) is 9,10-dihydroxyanthracene-1-diazonium.
What is the SMILES notation for 9,10-dihydroxyanthracene-1-diazonium?
The canonical SMILES for 9,10-dihydroxyanthracene-1-diazonium is N#[N+]c1cccc2c(O)c3ccccc3c(O)c12.
What is the InChIKey of 9,10-dihydroxyanthracene-1-diazonium?
The InChIKey is SSASYCDOBAXKNW-UHFFFAOYSA-O. The full InChI is InChI=1S/C14H8N2O2/c15-16-11-7-3-6-10-12(11)14(18)9-5-2-1-4-8(9)13(10)17/h1-7,15H/p+1.
What are the key properties of 9,10-dihydroxyanthracene-1-diazonium?
9,10-dihydroxyanthracene-1-diazonium has a molecular weight of 237.24 g/mol, XLogP of 3.89, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dihydroxyanthracene-1-diazonium is sourced from PubChem (CID 90949542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).