ethyl (2Z)-2-hydroxyimino-2-phenylacetate

C10H11NO3 — CID 15075005

IUPACethyl (2Z)-2-hydroxyimino-2-phenylacetate
SMILESCCOC(=O)/C(=N\O)c1ccccc1
InChIInChI=1S/C10H11NO3/c1-2-14-10(12)9(11-13)8-6-4-3-5-7-8/h3-7,13H,2H2,1H3/b11-9-
InChIKeyCYEGZACDKSTNKI-LUAWRHEFSA-N
MW193.20 g/mol
LogP1.43
Rot. Bonds3

About ethyl (2Z)-2-hydroxyimino-2-phenylacetate

ethyl (2Z)-2-hydroxyimino-2-phenylacetate (PubChem CID 15075005) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is ethyl (2Z)-2-hydroxyimino-2-phenylacetate.

Molecular Properties

Compound Nameethyl (2Z)-2-hydroxyimino-2-phenylacetate
PubChem CID15075005
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Nameethyl (2Z)-2-hydroxyimino-2-phenylacetate
SMILESCCOC(=O)/C(=N\O)c1ccccc1
InChIInChI=1S/C10H11NO3/c1-2-14-10(12)9(11-13)8-6-4-3-5-7-8/h3-7,13H,2H2,1H3/b11-9-
InChIKeyCYEGZACDKSTNKI-LUAWRHEFSA-N
XLogP1.43
TPSA58.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 51.43
H-Bond Donors ≤ 51
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'}

Analyze ethyl (2Z)-2-hydroxyimino-2-phenylacetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethyl 2-(acetylhydrazinylidene)-2-phenylacetate
CID 90720670
ethyl 2-oxo-2-phenylacetate
CID 15349
ethyl (2E)-2-hydroxyimino-2-(2-methoxyphenyl)acetate
CID 15075008
ethyl (2Z,4Z)-2,4-bis(hydroxyimino)-4-phenylbutanoate
CID 139266120
ethyl N-hydroxy-2-oxo-2-phenylethanimidate
CID 163663046
ethyl 4-hydroxy-2-oxo-4-phenylbut-3-enoate
CID 3863165
ethyl 2-[(4-chlorophenyl)hydrazinylidene]-2-phenylacetate
CID 87540078
ethyl (3Z)-3-hydrazinylidene-2-imino-3-phenylpropanoate
CID 142279990
ethyl 3-hydroxy-2-methyl-3-phenylprop-2-enoate
CID 174429046
ethyl 3-hydroxy-2-phenylbut-2-enoate
CID 138115443
ethyl (2E)-2-hydroxyimino-2-[4-(oxan-4-yl)phenyl]acetate
CID 123718793
ethyl (Z)-3-hydroxy-2,4-diphenylbut-2-enoate
CID 134119528

Frequently Asked Questions

What is the IUPAC name of ethyl (2Z)-2-hydroxyimino-2-phenylacetate?
The IUPAC name of ethyl (2Z)-2-hydroxyimino-2-phenylacetate (CID 15075005) is ethyl (2Z)-2-hydroxyimino-2-phenylacetate.
What is the SMILES notation for ethyl (2Z)-2-hydroxyimino-2-phenylacetate?
The canonical SMILES for ethyl (2Z)-2-hydroxyimino-2-phenylacetate is CCOC(=O)/C(=N\O)c1ccccc1.
What is the InChIKey of ethyl (2Z)-2-hydroxyimino-2-phenylacetate?
The InChIKey is CYEGZACDKSTNKI-LUAWRHEFSA-N. The full InChI is InChI=1S/C10H11NO3/c1-2-14-10(12)9(11-13)8-6-4-3-5-7-8/h3-7,13H,2H2,1H3/b11-9-.
What are the key properties of ethyl (2Z)-2-hydroxyimino-2-phenylacetate?
ethyl (2Z)-2-hydroxyimino-2-phenylacetate has a molecular weight of 193.20 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl (2Z)-2-hydroxyimino-2-phenylacetate is sourced from PubChem (CID 15075005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).