(4-chlorofuran-2-yl)-phenyldiazene

C10H7ClN2O — CID 101032132

IUPAC(4-chlorofuran-2-yl)-phenyldiazene
SMILESClc1coc(/N=N/c2ccccc2)c1
InChIInChI=1S/C10H7ClN2O/c11-8-6-10(14-7-8)13-12-9-4-2-1-3-5-9/h1-7H/b13-12+
InChIKeyNBBAMLCJJYDOQI-OUKQBFOZSA-N
MW206.63 g/mol
LogP4.35
Rot. Bonds2

About (4-chlorofuran-2-yl)-phenyldiazene

(4-chlorofuran-2-yl)-phenyldiazene (PubChem CID 101032132) has the molecular formula C10H7ClN2O and a molecular weight of 206.63 g/mol. Its IUPAC name is (4-chlorofuran-2-yl)-phenyldiazene.

Molecular Properties

Compound Name(4-chlorofuran-2-yl)-phenyldiazene
PubChem CID101032132
Molecular FormulaC10H7ClN2O
Molecular Weight206.63 g/mol
Exact Mass206.02
IUPAC Name(4-chlorofuran-2-yl)-phenyldiazene
SMILESClc1coc(/N=N/c2ccccc2)c1
InChIInChI=1S/C10H7ClN2O/c11-8-6-10(14-7-8)13-12-9-4-2-1-3-5-9/h1-7H/b13-12+
InChIKeyNBBAMLCJJYDOQI-OUKQBFOZSA-N
XLogP4.35
TPSA37.86 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.63
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-chlorofuran-2-yl)-phenyldiazene?
The IUPAC name of (4-chlorofuran-2-yl)-phenyldiazene (CID 101032132) is (4-chlorofuran-2-yl)-phenyldiazene.
What is the SMILES notation for (4-chlorofuran-2-yl)-phenyldiazene?
The canonical SMILES for (4-chlorofuran-2-yl)-phenyldiazene is Clc1coc(/N=N/c2ccccc2)c1.
What is the InChIKey of (4-chlorofuran-2-yl)-phenyldiazene?
The InChIKey is NBBAMLCJJYDOQI-OUKQBFOZSA-N. The full InChI is InChI=1S/C10H7ClN2O/c11-8-6-10(14-7-8)13-12-9-4-2-1-3-5-9/h1-7H/b13-12+.
What are the key properties of (4-chlorofuran-2-yl)-phenyldiazene?
(4-chlorofuran-2-yl)-phenyldiazene has a molecular weight of 206.63 g/mol, XLogP of 4.35, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorofuran-2-yl)-phenyldiazene is sourced from PubChem (CID 101032132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).