2-(2-benzylidenehydrazinyl)ethanol

C9H12N2O — CID 70531719

IUPAC2-(2-benzylidenehydrazinyl)ethanol
SMILESOCCNN=Cc1ccccc1
InChIInChI=1S/C9H12N2O/c12-7-6-10-11-8-9-4-2-1-3-5-9/h1-5,8,10,12H,6-7H2
InChIKeyPLNZJVAPCYKCDJ-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.60
Rot. Bonds4

About 2-(2-benzylidenehydrazinyl)ethanol

2-(2-benzylidenehydrazinyl)ethanol (PubChem CID 70531719) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 2-(2-benzylidenehydrazinyl)ethanol.

Molecular Properties

Compound Name2-(2-benzylidenehydrazinyl)ethanol
PubChem CID70531719
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name2-(2-benzylidenehydrazinyl)ethanol
SMILESOCCNN=Cc1ccccc1
InChIInChI=1S/C9H12N2O/c12-7-6-10-11-8-9-4-2-1-3-5-9/h1-5,8,10,12H,6-7H2
InChIKeyPLNZJVAPCYKCDJ-UHFFFAOYSA-N
XLogP0.60
TPSA44.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-benzylidenehydrazinyl)ethanol?
The IUPAC name of 2-(2-benzylidenehydrazinyl)ethanol (CID 70531719) is 2-(2-benzylidenehydrazinyl)ethanol.
What is the SMILES notation for 2-(2-benzylidenehydrazinyl)ethanol?
The canonical SMILES for 2-(2-benzylidenehydrazinyl)ethanol is OCCNN=Cc1ccccc1.
What is the InChIKey of 2-(2-benzylidenehydrazinyl)ethanol?
The InChIKey is PLNZJVAPCYKCDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c12-7-6-10-11-8-9-4-2-1-3-5-9/h1-5,8,10,12H,6-7H2.
What are the key properties of 2-(2-benzylidenehydrazinyl)ethanol?
2-(2-benzylidenehydrazinyl)ethanol has a molecular weight of 164.21 g/mol, XLogP of 0.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzylidenehydrazinyl)ethanol is sourced from PubChem (CID 70531719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).