2-(2-chloro-5-nitrophenyl)furan

C10H6ClNO3 — CID 15318128

IUPAC2-(2-chloro-5-nitrophenyl)furan
SMILESO=[N+]([O-])c1ccc(Cl)c(-c2ccco2)c1
InChIInChI=1S/C10H6ClNO3/c11-9-4-3-7(12(13)14)6-8(9)10-2-1-5-15-10/h1-6H
InChIKeyVOMNUVIXTYSIMG-UHFFFAOYSA-N
MW223.62 g/mol
LogP3.51
Rot. Bonds2

About 2-(2-chloro-5-nitrophenyl)furan

2-(2-chloro-5-nitrophenyl)furan (PubChem CID 15318128) has the molecular formula C10H6ClNO3 and a molecular weight of 223.62 g/mol. Its IUPAC name is 2-(2-chloro-5-nitrophenyl)furan.

Molecular Properties

Compound Name2-(2-chloro-5-nitrophenyl)furan
PubChem CID15318128
Molecular FormulaC10H6ClNO3
Molecular Weight223.62 g/mol
Exact Mass223.00
IUPAC Name2-(2-chloro-5-nitrophenyl)furan
SMILESO=[N+]([O-])c1ccc(Cl)c(-c2ccco2)c1
InChIInChI=1S/C10H6ClNO3/c11-9-4-3-7(12(13)14)6-8(9)10-2-1-5-15-10/h1-6H
InChIKeyVOMNUVIXTYSIMG-UHFFFAOYSA-N
XLogP3.51
TPSA56.28 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.62
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(furan-2-yl)-5-nitrobenzenethiol
CID 168527831
1,3,5-trichloro-2-(2-chloro-5-nitrophenyl)benzene
CID 134630362
5-(2-chloro-5-nitrophenyl)furan-2-carboxylic acid
CID 960728
2-(2-chloro-5-nitrophenyl)-1,3,4-oxadiazole
CID 71563519
[2-(furan-2-yl)-5-nitrophenyl]-phenylmethanone
CID 168528552
2-chloro-1-(2-chloro-5-nitrophenyl)-3-nitrobenzene
CID 171785769
(E)-3-(2-chloro-5-nitrophenyl)-1-(furan-2-yl)prop-2-en-1-one
CID 6187791
(2-chloro-4-nitrophenyl)-(furan-2-yl)methanone
CID 18967626
1-chloro-2-(4-methylphenyl)-4-nitrobenzene;formamide
CID 144972005
2-chloro-5-nitrobenzoate;furan-2-ylmethylazanium
CID 171118088
(5E)-5-[[5-(2-chloro-5-nitrophenyl)furan-2-yl]methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione
CID 96880357
bis[3-(2-chloro-5-nitrophenyl)thiophen-2-yl]methanone
CID 88595016

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-5-nitrophenyl)furan?
The IUPAC name of 2-(2-chloro-5-nitrophenyl)furan (CID 15318128) is 2-(2-chloro-5-nitrophenyl)furan.
What is the SMILES notation for 2-(2-chloro-5-nitrophenyl)furan?
The canonical SMILES for 2-(2-chloro-5-nitrophenyl)furan is O=[N+]([O-])c1ccc(Cl)c(-c2ccco2)c1.
What is the InChIKey of 2-(2-chloro-5-nitrophenyl)furan?
The InChIKey is VOMNUVIXTYSIMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClNO3/c11-9-4-3-7(12(13)14)6-8(9)10-2-1-5-15-10/h1-6H.
What are the key properties of 2-(2-chloro-5-nitrophenyl)furan?
2-(2-chloro-5-nitrophenyl)furan has a molecular weight of 223.62 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-5-nitrophenyl)furan is sourced from PubChem (CID 15318128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).