(1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine

C11H23F3N2 — CID 105313990

IUPAC(1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine
SMILESCC(CC(CCC(F)(F)F)NN)C(C)(C)C
InChIInChI=1S/C11H23F3N2/c1-8(10(2,3)4)7-9(16-15)5-6-11(12,13)14/h8-9,16H,5-7,15H2,1-4H3
InChIKeyOFZGIPVHQLYFSB-UHFFFAOYSA-N
MW240.31 g/mol
LogP3.23
Rot. Bonds5

About (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine

(1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine (PubChem CID 105313990) has the molecular formula C11H23F3N2 and a molecular weight of 240.31 g/mol. Its IUPAC name is (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine.

Molecular Properties

Compound Name(1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine
PubChem CID105313990
Molecular FormulaC11H23F3N2
Molecular Weight240.31 g/mol
Exact Mass240.18
IUPAC Name(1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine
SMILESCC(CC(CCC(F)(F)F)NN)C(C)(C)C
InChIInChI=1S/C11H23F3N2/c1-8(10(2,3)4)7-9(16-15)5-6-11(12,13)14/h8-9,16H,5-7,15H2,1-4H3
InChIKeyOFZGIPVHQLYFSB-UHFFFAOYSA-N
XLogP3.23
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine?
The IUPAC name of (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine (CID 105313990) is (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine.
What is the SMILES notation for (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine?
The canonical SMILES for (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine is CC(CC(CCC(F)(F)F)NN)C(C)(C)C.
What is the InChIKey of (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine?
The InChIKey is OFZGIPVHQLYFSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23F3N2/c1-8(10(2,3)4)7-9(16-15)5-6-11(12,13)14/h8-9,16H,5-7,15H2,1-4H3.
What are the key properties of (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine?
(1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine has a molecular weight of 240.31 g/mol, XLogP of 3.23, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1,1-trifluoro-6,7,7-trimethyloctan-4-yl)hydrazine is sourced from PubChem (CID 105313990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).