2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid

C8H9ClN2O3 — CID 130779254

IUPAC2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid
SMILESNNc1ccc(Cl)cc1C(O)C(=O)O
InChIInChI=1S/C8H9ClN2O3/c9-4-1-2-6(11-10)5(3-4)7(12)8(13)14/h1-3,7,11-12H,10H2,(H,13,14)
InChIKeyMULLONKWYZANIA-UHFFFAOYSA-N
MW216.62 g/mol
LogP0.74
Rot. Bonds3

About 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid

2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid (PubChem CID 130779254) has the molecular formula C8H9ClN2O3 and a molecular weight of 216.62 g/mol. Its IUPAC name is 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid.

Molecular Properties

Compound Name2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid
PubChem CID130779254
Molecular FormulaC8H9ClN2O3
Molecular Weight216.62 g/mol
Exact Mass216.03
IUPAC Name2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid
SMILESNNc1ccc(Cl)cc1C(O)C(=O)O
InChIInChI=1S/C8H9ClN2O3/c9-4-1-2-6(11-10)5(3-4)7(12)8(13)14/h1-3,7,11-12H,10H2,(H,13,14)
InChIKeyMULLONKWYZANIA-UHFFFAOYSA-N
XLogP0.74
TPSA95.58 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.62
LogP ≤ 50.74
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(5-bromo-2-hydrazinylphenyl)-2-hydroxyacetic acid
CID 131011158
2-(2-amino-4-chlorophenyl)-2-hydroxyacetic acid
CID 119022800
bis((2R)-2-(4-chloro-2-fluorophenyl)-2-hydroxyacetic acid);bis((2S)-2-(4-chloro-2-fluorophenyl)-2-hydroxyacetic acid)
CID 139124387
2-[5-chloro-2-(1-chloro-2-oxopropyl)phenyl]-2-hydroxyacetic acid
CID 134656015
2-(2-amino-3-hydrazinylphenyl)-2-hydroxyacetic acid
CID 119012765
2-[5-chloro-2-(3-chloro-2-oxopropyl)phenyl]-2-hydroxyacetic acid
CID 134656021
2-[5-chloro-2-(2,3,5-trichlorophenyl)phenyl]-2-hydroxyacetic acid
CID 134633845
2-(2,3-dichloro-4-fluorophenyl)-2-hydroxyacetic acid
CID 119001488
(5-chloro-2-methoxyphenyl)hydrazine;oxalic acid
CID 175007834
2-[4-chloro-2-(2,4,5-trichlorophenyl)phenyl]-2-hydroxyacetic acid
CID 134633869
(2S)-2-(4-chlorophenyl)-2-hydroxyacetic acid
CID 785083
(2,4-dichlorophenyl)hydrazine;methane
CID 54772277

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid?
The IUPAC name of 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid (CID 130779254) is 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid.
What is the SMILES notation for 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid?
The canonical SMILES for 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid is NNc1ccc(Cl)cc1C(O)C(=O)O.
What is the InChIKey of 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid?
The InChIKey is MULLONKWYZANIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9ClN2O3/c9-4-1-2-6(11-10)5(3-4)7(12)8(13)14/h1-3,7,11-12H,10H2,(H,13,14).
What are the key properties of 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid?
2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid has a molecular weight of 216.62 g/mol, XLogP of 0.74, 3 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-hydrazinylphenyl)-2-hydroxyacetic acid is sourced from PubChem (CID 130779254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).