2-chloro-10-hydroxyanthracene-9-diazonium

C14H8ClN2O+ — CID 20536808

IUPAC2-chloro-10-hydroxyanthracene-9-diazonium
SMILESN#[N+]c1c2ccccc2c(O)c2ccc(Cl)cc12
InChIInChI=1S/C14H7ClN2O/c15-8-5-6-11-12(7-8)13(17-16)9-3-1-2-4-10(9)14(11)18/h1-7H/p+1
InChIKeyCNKKGOQJYINHLK-UHFFFAOYSA-O
MW255.68 g/mol
LogP4.84
Rot. Bonds

About 2-chloro-10-hydroxyanthracene-9-diazonium

2-chloro-10-hydroxyanthracene-9-diazonium (PubChem CID 20536808) has the molecular formula C14H8ClN2O+ and a molecular weight of 255.68 g/mol. Its IUPAC name is 2-chloro-10-hydroxyanthracene-9-diazonium.

Molecular Properties

Compound Name2-chloro-10-hydroxyanthracene-9-diazonium
PubChem CID20536808
Molecular FormulaC14H8ClN2O+
Molecular Weight255.68 g/mol
Exact Mass255.03
IUPAC Name2-chloro-10-hydroxyanthracene-9-diazonium
SMILESN#[N+]c1c2ccccc2c(O)c2ccc(Cl)cc12
InChIInChI=1S/C14H7ClN2O/c15-8-5-6-11-12(7-8)13(17-16)9-3-1-2-4-10(9)14(11)18/h1-7H/p+1
InChIKeyCNKKGOQJYINHLK-UHFFFAOYSA-O
XLogP4.84
TPSA48.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.68
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-chloro-10-hydroxyanthracene-9-diazonium with MolForge

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

Launch Full Analysis

Related Compounds

6-chloro-2-methyl-4-phenylnaphthalen-1-ol
CID 11054690
benzene-1,2-diol;4-chlorobenzene-1,2-diol
CID 22153361
9,10-dihydroxyanthracene-1-diazonium
CID 90949542
acetic acid;6-chloro-2,3-diphenoxynaphthalene-1,4-diol
CID 71331804
anthracene-1,2,10-triol
CID 11342
4-chloronaphthalene-1,2-diol diacetate
CID 53440062
2,3-bis(4-chlorophenoxy)naphthalene-1,4-diol
CID 19886874
2-chloro-9,10-diethynylanthracene
CID 21113563
4-chloro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1,2-diol
CID 171689350
10-chlorophenanthro[9,10-b]pyrazine
CID 121296750
2-chloro-6,12-diphenylchrysene
CID 58501171
3-aminoanthracene-2,9,10-triol
CID 90904436

Frequently Asked Questions

What is the IUPAC name of 2-chloro-10-hydroxyanthracene-9-diazonium?
The IUPAC name of 2-chloro-10-hydroxyanthracene-9-diazonium (CID 20536808) is 2-chloro-10-hydroxyanthracene-9-diazonium.
What is the SMILES notation for 2-chloro-10-hydroxyanthracene-9-diazonium?
The canonical SMILES for 2-chloro-10-hydroxyanthracene-9-diazonium is N#[N+]c1c2ccccc2c(O)c2ccc(Cl)cc12.
What is the InChIKey of 2-chloro-10-hydroxyanthracene-9-diazonium?
The InChIKey is CNKKGOQJYINHLK-UHFFFAOYSA-O. The full InChI is InChI=1S/C14H7ClN2O/c15-8-5-6-11-12(7-8)13(17-16)9-3-1-2-4-10(9)14(11)18/h1-7H/p+1.
What are the key properties of 2-chloro-10-hydroxyanthracene-9-diazonium?
2-chloro-10-hydroxyanthracene-9-diazonium has a molecular weight of 255.68 g/mol, XLogP of 4.84, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-10-hydroxyanthracene-9-diazonium is sourced from PubChem (CID 20536808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).