oxalic acid;2-phenylpropan-2-ylhydrazine

C11H16N2O4 — CID 71388863

IUPACoxalic acid;2-phenylpropan-2-ylhydrazine
SMILESCC(C)(NN)c1ccccc1.O=C(O)C(=O)O
InChIInChI=1S/C9H14N2.C2H2O4/c1-9(2,11-10)8-6-4-3-5-7-8;3-1(4)2(5)6/h3-7,11H,10H2,1-2H3;(H,3,4)(H,5,6)
InChIKeyRLVTWSLZFHTDPA-UHFFFAOYSA-N
MW240.26 g/mol
LogP0.54
Rot. Bonds2

About oxalic acid;2-phenylpropan-2-ylhydrazine

oxalic acid;2-phenylpropan-2-ylhydrazine (PubChem CID 71388863) has the molecular formula C11H16N2O4 and a molecular weight of 240.26 g/mol. Its IUPAC name is oxalic acid;2-phenylpropan-2-ylhydrazine.

Molecular Properties

Compound Nameoxalic acid;2-phenylpropan-2-ylhydrazine
PubChem CID71388863
Molecular FormulaC11H16N2O4
Molecular Weight240.26 g/mol
Exact Mass240.11
IUPAC Nameoxalic acid;2-phenylpropan-2-ylhydrazine
SMILESCC(C)(NN)c1ccccc1.O=C(O)C(=O)O
InChIInChI=1S/C9H14N2.C2H2O4/c1-9(2,11-10)8-6-4-3-5-7-8;3-1(4)2(5)6/h3-7,11H,10H2,1-2H3;(H,3,4)(H,5,6)
InChIKeyRLVTWSLZFHTDPA-UHFFFAOYSA-N
XLogP0.54
TPSA112.65 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 50.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', '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 oxalic acid;2-phenylpropan-2-ylhydrazine?
The IUPAC name of oxalic acid;2-phenylpropan-2-ylhydrazine (CID 71388863) is oxalic acid;2-phenylpropan-2-ylhydrazine.
What is the SMILES notation for oxalic acid;2-phenylpropan-2-ylhydrazine?
The canonical SMILES for oxalic acid;2-phenylpropan-2-ylhydrazine is CC(C)(NN)c1ccccc1.O=C(O)C(=O)O.
What is the InChIKey of oxalic acid;2-phenylpropan-2-ylhydrazine?
The InChIKey is RLVTWSLZFHTDPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2.C2H2O4/c1-9(2,11-10)8-6-4-3-5-7-8;3-1(4)2(5)6/h3-7,11H,10H2,1-2H3;(H,3,4)(H,5,6).
What are the key properties of oxalic acid;2-phenylpropan-2-ylhydrazine?
oxalic acid;2-phenylpropan-2-ylhydrazine has a molecular weight of 240.26 g/mol, XLogP of 0.54, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxalic acid;2-phenylpropan-2-ylhydrazine is sourced from PubChem (CID 71388863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).