(2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid

C6H5NO4 — CID 14556124

IUPAC(2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid
SMILESO=C(O)/C(=N\O)c1ccco1
InChIInChI=1S/C6H5NO4/c8-6(9)5(7-10)4-2-1-3-11-4/h1-3,10H,(H,8,9)/b7-5-
InChIKeyRNNIWANKYVVTII-ALCCZGGFSA-N
MW155.11 g/mol
LogP0.54
Rot. Bonds2

About (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid

(2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid (PubChem CID 14556124) has the molecular formula C6H5NO4 and a molecular weight of 155.11 g/mol. Its IUPAC name is (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid.

Molecular Properties

Compound Name(2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid
PubChem CID14556124
Molecular FormulaC6H5NO4
Molecular Weight155.11 g/mol
Exact Mass155.02
IUPAC Name(2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid
SMILESO=C(O)/C(=N\O)c1ccco1
InChIInChI=1S/C6H5NO4/c8-6(9)5(7-10)4-2-1-3-11-4/h1-3,10H,(H,8,9)/b7-5-
InChIKeyRNNIWANKYVVTII-ALCCZGGFSA-N
XLogP0.54
TPSA83.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.11
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2E)-1,2-bis(furan-2-yl)-2-hydroxyiminoethanone
CID 6401304
bis((NZ)-N-[(2Z)-1,2-bis(furan-2-yl)-2-hydroxyiminoethylidene]hydroxylamine);copper
CID 135436493
methyl (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetate
CID 87793315
(3Z)-3-(furan-2-yl)-3-hydroxyiminopropanoic acid
CID 55250666
zinc furan-2-carboxylic acid
CID 25022579
furan-2-carboxylic acid;gold
CID 174701575
furan-2-carboxylic acid;silver
CID 87285311
2-cyclopentyloxyimino-2-(furan-2-yl)acetic acid
CID 54233650
furan-2-carboxylic acid;methanol
CID 70611195
furan-2-carboxylic acid;methanamine
CID 82372767
(2Z)-2-(1H-benzimidazol-2-ylhydrazinylidene)-2-(furan-2-yl)acetic acid
CID 10778432
furan-2-yl(phosphanyl)methanone
CID 151549332

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid?
The IUPAC name of (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid (CID 14556124) is (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid.
What is the SMILES notation for (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid?
The canonical SMILES for (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid is O=C(O)/C(=N\O)c1ccco1.
What is the InChIKey of (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid?
The InChIKey is RNNIWANKYVVTII-ALCCZGGFSA-N. The full InChI is InChI=1S/C6H5NO4/c8-6(9)5(7-10)4-2-1-3-11-4/h1-3,10H,(H,8,9)/b7-5-.
What are the key properties of (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid?
(2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid has a molecular weight of 155.11 g/mol, XLogP of 0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid is sourced from PubChem (CID 14556124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).