(8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine

C9H19F3N2O — CID 105270659

IUPAC(8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine
SMILESCCC(OC)C(CCCC(F)(F)F)NN
InChIInChI=1S/C9H19F3N2O/c1-3-8(15-2)7(14-13)5-4-6-9(10,11)12/h7-8,14H,3-6,13H2,1-2H3
InChIKeyQMXZONYFYBZVCC-UHFFFAOYSA-N
MW228.26 g/mol
LogP1.98
Rot. Bonds7

About (8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine

(8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine (PubChem CID 105270659) has the molecular formula C9H19F3N2O and a molecular weight of 228.26 g/mol. Its IUPAC name is (8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine.

Molecular Properties

Compound Name(8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine
PubChem CID105270659
Molecular FormulaC9H19F3N2O
Molecular Weight228.26 g/mol
Exact Mass228.14
IUPAC Name(8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine
SMILESCCC(OC)C(CCCC(F)(F)F)NN
InChIInChI=1S/C9H19F3N2O/c1-3-8(15-2)7(14-13)5-4-6-9(10,11)12/h7-8,14H,3-6,13H2,1-2H3
InChIKeyQMXZONYFYBZVCC-UHFFFAOYSA-N
XLogP1.98
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.26
LogP ≤ 51.98
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-methoxyoctan-4-yl)hydrazine?
The IUPAC name of (8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine (CID 105270659) is (8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine.
What is the SMILES notation for (8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine?
The canonical SMILES for (8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine is CCC(OC)C(CCCC(F)(F)F)NN.
What is the InChIKey of (8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine?
The InChIKey is QMXZONYFYBZVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19F3N2O/c1-3-8(15-2)7(14-13)5-4-6-9(10,11)12/h7-8,14H,3-6,13H2,1-2H3.
What are the key properties of (8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine?
(8,8,8-trifluoro-3-methoxyoctan-4-yl)hydrazine has a molecular weight of 228.26 g/mol, XLogP of 1.98, 7 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-methoxyoctan-4-yl)hydrazine is sourced from PubChem (CID 105270659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).