(8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine

C11H23F3N2O — CID 105273405

IUPAC(8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine
SMILESCOC(C(CCCC(F)(F)F)NN)C(C)(C)C
InChIInChI=1S/C11H23F3N2O/c1-10(2,3)9(17-4)8(16-15)6-5-7-11(12,13)14/h8-9,16H,5-7,15H2,1-4H3
InChIKeyVDTVQYAFIUAQGK-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.61
Rot. Bonds6

About (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine

(8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine (PubChem CID 105273405) has the molecular formula C11H23F3N2O and a molecular weight of 256.31 g/mol. Its IUPAC name is (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine.

Molecular Properties

Compound Name(8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine
PubChem CID105273405
Molecular FormulaC11H23F3N2O
Molecular Weight256.31 g/mol
Exact Mass256.18
IUPAC Name(8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine
SMILESCOC(C(CCCC(F)(F)F)NN)C(C)(C)C
InChIInChI=1S/C11H23F3N2O/c1-10(2,3)9(17-4)8(16-15)6-5-7-11(12,13)14/h8-9,16H,5-7,15H2,1-4H3
InChIKeyVDTVQYAFIUAQGK-UHFFFAOYSA-N
XLogP2.61
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine?
The IUPAC name of (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine (CID 105273405) is (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine.
What is the SMILES notation for (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine?
The canonical SMILES for (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine is COC(C(CCCC(F)(F)F)NN)C(C)(C)C.
What is the InChIKey of (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine?
The InChIKey is VDTVQYAFIUAQGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23F3N2O/c1-10(2,3)9(17-4)8(16-15)6-5-7-11(12,13)14/h8-9,16H,5-7,15H2,1-4H3.
What are the key properties of (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine?
(8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine has a molecular weight of 256.31 g/mol, XLogP of 2.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8,8,8-trifluoro-3-methoxy-2,2-dimethyloctan-4-yl)hydrazine is sourced from PubChem (CID 105273405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).