(E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium

C15H15N2O4+ — CID 11076995

IUPAC(E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium
SMILESN#[N+]/C=C(\O)OCc1ccccc1COCc1ccco1
InChIInChI=1S/C15H14N2O4/c16-17-8-15(18)21-10-13-5-2-1-4-12(13)9-19-11-14-6-3-7-20-14/h1-8H,9-11H2/p+1/b15-8+
InChIKeyPTEIINOZHFMDBC-OVCLIPMQSA-O
MW287.30 g/mol
LogP3.72
Rot. Bonds7

About (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium

(E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium (PubChem CID 11076995) has the molecular formula C15H15N2O4+ and a molecular weight of 287.30 g/mol. Its IUPAC name is (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium.

Molecular Properties

Compound Name(E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium
PubChem CID11076995
Molecular FormulaC15H15N2O4+
Molecular Weight287.30 g/mol
Exact Mass287.10
IUPAC Name(E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium
SMILESN#[N+]/C=C(\O)OCc1ccccc1COCc1ccco1
InChIInChI=1S/C15H14N2O4/c16-17-8-15(18)21-10-13-5-2-1-4-12(13)9-19-11-14-6-3-7-20-14/h1-8H,9-11H2/p+1/b15-8+
InChIKeyPTEIINOZHFMDBC-OVCLIPMQSA-O
XLogP3.72
TPSA79.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.30
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Azo_group', 'substructure': 'N/A'}

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Related Compounds

2-[(2-fluorophenyl)methoxymethyl]furan
CID 70570025
3-(furan-2-ylmethoxymethyl)-2-methylaniline
CID 43509271
2-fluoro-3-(furan-2-ylmethoxymethyl)-N'-hydroxybenzenecarboximidamide
CID 107117587
2-(furan-2-ylmethoxymethyl)furan;propane-1,2,3-triol
CID 174940429
[2-(furan-2-ylmethoxymethyl)phenyl] N-methylcarbamate
CID 54506260
2-[2-[2-[2-[2-(furan-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxymethyl]furan
CID 102488556
3-bromo-4-(furan-2-ylmethoxymethyl)aniline
CID 60792139
2-(fluoromethoxymethyl)furan
CID 143116843
3-(furan-2-ylmethoxy)propanoic acid
CID 24710839
2-amino-3-(furan-2-ylmethoxy)propanoic acid
CID 65443764
4-(furan-2-ylmethoxymethyl)benzenecarbothioamide
CID 24697058
4-(chloromethyl)-2-[2-(furan-2-ylmethoxymethyl)phenyl]-1,3-thiazole
CID 43320209

Frequently Asked Questions

What is the IUPAC name of (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium?
The IUPAC name of (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium (CID 11076995) is (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium.
What is the SMILES notation for (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium?
The canonical SMILES for (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium is N#[N+]/C=C(\O)OCc1ccccc1COCc1ccco1.
What is the InChIKey of (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium?
The InChIKey is PTEIINOZHFMDBC-OVCLIPMQSA-O. The full InChI is InChI=1S/C15H14N2O4/c16-17-8-15(18)21-10-13-5-2-1-4-12(13)9-19-11-14-6-3-7-20-14/h1-8H,9-11H2/p+1/b15-8+.
What are the key properties of (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium?
(E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium has a molecular weight of 287.30 g/mol, XLogP of 3.72, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-[[2-(furan-2-ylmethoxymethyl)phenyl]methoxy]-2-hydroxyethenediazonium is sourced from PubChem (CID 11076995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).