2-hydroxyfluoranthene-3-diazonium

C16H9N2O+ — CID 10490474

IUPAC2-hydroxyfluoranthene-3-diazonium
SMILESN#[N+]c1c(O)cc2c3c(cccc13)-c1ccccc1-2
InChIInChI=1S/C16H8N2O/c17-18-16-12-7-3-6-11-9-4-1-2-5-10(9)13(15(11)12)8-14(16)19/h1-8H/p+1
InChIKeyKONZWSHVZXDWCL-UHFFFAOYSA-O
MW245.26 g/mol
LogP4.68
Rot. Bonds

About 2-hydroxyfluoranthene-3-diazonium

2-hydroxyfluoranthene-3-diazonium (PubChem CID 10490474) has the molecular formula C16H9N2O+ and a molecular weight of 245.26 g/mol. Its IUPAC name is 2-hydroxyfluoranthene-3-diazonium.

Molecular Properties

Compound Name2-hydroxyfluoranthene-3-diazonium
PubChem CID10490474
Molecular FormulaC16H9N2O+
Molecular Weight245.26 g/mol
Exact Mass245.07
IUPAC Name2-hydroxyfluoranthene-3-diazonium
SMILESN#[N+]c1c(O)cc2c3c(cccc13)-c1ccccc1-2
InChIInChI=1S/C16H8N2O/c17-18-16-12-7-3-6-11-9-4-1-2-5-10(9)13(15(11)12)8-14(16)19/h1-8H/p+1
InChIKeyKONZWSHVZXDWCL-UHFFFAOYSA-O
XLogP4.68
TPSA48.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[12-(6-hexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5(10),6,8,11,13(24),14,16,18,20,22-dodecaenyl)chrysen-6-yl]hexacyclo[11.10.1.02,11.05,10.014,19.020,24]tetracosa-1,3,5,7,9,11,13(24),14,16,18,20,22-dodecaene
CID 59330314
dodecacyclo[31.11.1.111,19.02,32.04,30.05,27.08,26.010,24.013,18.037,45.038,43.023,46]hexatetraconta-1(44),2(32),3,5(27),6,8,10(24),11,13,15,17,19(46),20,22,25,28,30,33,35,37(45),38,40,42-tricosaene
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9,10-dihydroxyanthracene-1-diazonium
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decacyclo[22.9.2.17,11.02,20.04,18.06,16.021,34.025,30.031,35.015,36]hexatriaconta-1(34),2,4,6(16),7,9,11(36),12,14,17,19,21,23,25,27,29,31(35),32-octadecaene
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Frequently Asked Questions

What is the IUPAC name of 2-hydroxyfluoranthene-3-diazonium?
The IUPAC name of 2-hydroxyfluoranthene-3-diazonium (CID 10490474) is 2-hydroxyfluoranthene-3-diazonium.
What is the SMILES notation for 2-hydroxyfluoranthene-3-diazonium?
The canonical SMILES for 2-hydroxyfluoranthene-3-diazonium is N#[N+]c1c(O)cc2c3c(cccc13)-c1ccccc1-2.
What is the InChIKey of 2-hydroxyfluoranthene-3-diazonium?
The InChIKey is KONZWSHVZXDWCL-UHFFFAOYSA-O. The full InChI is InChI=1S/C16H8N2O/c17-18-16-12-7-3-6-11-9-4-1-2-5-10(9)13(15(11)12)8-14(16)19/h1-8H/p+1.
What are the key properties of 2-hydroxyfluoranthene-3-diazonium?
2-hydroxyfluoranthene-3-diazonium has a molecular weight of 245.26 g/mol, XLogP of 4.68, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyfluoranthene-3-diazonium is sourced from PubChem (CID 10490474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).