(E)-dinaphthalen-1-yloxydiazene

C20H14N2O2 — CID 67562548

IUPAC(E)-dinaphthalen-1-yloxydiazene
SMILESc1ccc2c(O/N=N/Oc3cccc4ccccc34)cccc2c1
InChIInChI=1S/C20H14N2O2/c1-3-11-17-15(7-1)9-5-13-19(17)23-21-22-24-20-14-6-10-16-8-2-4-12-18(16)20/h1-14H/b22-21+
InChIKeyIUGBKHNNTQYSBK-QURGRASLSA-N
MW314.34 g/mol
LogP5.73
Rot. Bonds4

About (E)-dinaphthalen-1-yloxydiazene

(E)-dinaphthalen-1-yloxydiazene (PubChem CID 67562548) has the molecular formula C20H14N2O2 and a molecular weight of 314.34 g/mol. Its IUPAC name is (E)-dinaphthalen-1-yloxydiazene.

Molecular Properties

Compound Name(E)-dinaphthalen-1-yloxydiazene
PubChem CID67562548
Molecular FormulaC20H14N2O2
Molecular Weight314.34 g/mol
Exact Mass314.11
IUPAC Name(E)-dinaphthalen-1-yloxydiazene
SMILESc1ccc2c(O/N=N/Oc3cccc4ccccc34)cccc2c1
InChIInChI=1S/C20H14N2O2/c1-3-11-17-15(7-1)9-5-13-19(17)23-21-22-24-20-14-6-10-16-8-2-4-12-18(16)20/h1-14H/b22-21+
InChIKeyIUGBKHNNTQYSBK-QURGRASLSA-N
XLogP5.73
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.34
LogP ≤ 55.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

acetic acid;2-naphthalen-1-yloxyguanidine
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benzene;naphthalen-1-yloxymethanol
CID 70447137
1-(2-nitrosophenoxy)naphthalene
CID 154946656
1-(2,6-difluorophenoxy)naphthalene
CID 90910204
1-(3-chloropropoxy)naphthalene
CID 12685615
2-naphthalen-1-yloxy-1-(2-naphthalen-1-yloxynaphthalen-1-yl)naphthalene
CID 58689928
lithium;1-ethoxynaphthalene;hydride
CID 174613942
naphthalen-1-yl sulfamate
CID 25056076
1-phenylsulfanyloxynaphthalene
CID 174251296
1-(trifluoromethylsulfanyloxy)naphthalene
CID 175533116

Frequently Asked Questions

What is the IUPAC name of (E)-dinaphthalen-1-yloxydiazene?
The IUPAC name of (E)-dinaphthalen-1-yloxydiazene (CID 67562548) is (E)-dinaphthalen-1-yloxydiazene.
What is the SMILES notation for (E)-dinaphthalen-1-yloxydiazene?
The canonical SMILES for (E)-dinaphthalen-1-yloxydiazene is c1ccc2c(O/N=N/Oc3cccc4ccccc34)cccc2c1.
What is the InChIKey of (E)-dinaphthalen-1-yloxydiazene?
The InChIKey is IUGBKHNNTQYSBK-QURGRASLSA-N. The full InChI is InChI=1S/C20H14N2O2/c1-3-11-17-15(7-1)9-5-13-19(17)23-21-22-24-20-14-6-10-16-8-2-4-12-18(16)20/h1-14H/b22-21+.
What are the key properties of (E)-dinaphthalen-1-yloxydiazene?
(E)-dinaphthalen-1-yloxydiazene has a molecular weight of 314.34 g/mol, XLogP of 5.73, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-dinaphthalen-1-yloxydiazene is sourced from PubChem (CID 67562548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).