(1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine

C12H28N2O2 — CID 103026298

IUPAC(1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine
SMILESCCOCCCC(CCC(C)(C)OC)NN
InChIInChI=1S/C12H28N2O2/c1-5-16-10-6-7-11(14-13)8-9-12(2,3)15-4/h11,14H,5-10,13H2,1-4H3
InChIKeyPYUPXGUTEYLJQY-UHFFFAOYSA-N
MW232.37 g/mol
LogP1.84
Rot. Bonds10

About (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine

(1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine (PubChem CID 103026298) has the molecular formula C12H28N2O2 and a molecular weight of 232.37 g/mol. Its IUPAC name is (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine.

Molecular Properties

Compound Name(1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine
PubChem CID103026298
Molecular FormulaC12H28N2O2
Molecular Weight232.37 g/mol
Exact Mass232.22
IUPAC Name(1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine
SMILESCCOCCCC(CCC(C)(C)OC)NN
InChIInChI=1S/C12H28N2O2/c1-5-16-10-6-7-11(14-13)8-9-12(2,3)15-4/h11,14H,5-10,13H2,1-4H3
InChIKeyPYUPXGUTEYLJQY-UHFFFAOYSA-N
XLogP1.84
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine?
The IUPAC name of (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine (CID 103026298) is (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine.
What is the SMILES notation for (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine?
The canonical SMILES for (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine is CCOCCCC(CCC(C)(C)OC)NN.
What is the InChIKey of (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine?
The InChIKey is PYUPXGUTEYLJQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2O2/c1-5-16-10-6-7-11(14-13)8-9-12(2,3)15-4/h11,14H,5-10,13H2,1-4H3.
What are the key properties of (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine?
(1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine has a molecular weight of 232.37 g/mol, XLogP of 1.84, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxy-7-methoxy-7-methyloctan-4-yl)hydrazine is sourced from PubChem (CID 103026298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).