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

C10H21F3N2O — CID 105272049

IUPAC(8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine
SMILESCOC(C(C)C)C(CCCC(F)(F)F)NN
InChIInChI=1S/C10H21F3N2O/c1-7(2)9(16-3)8(15-14)5-4-6-10(11,12)13/h7-9,15H,4-6,14H2,1-3H3
InChIKeyLGYWQLORMGPZAR-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.22
Rot. Bonds7

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

(8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine (PubChem CID 105272049) has the molecular formula C10H21F3N2O and a molecular weight of 242.28 g/mol. Its IUPAC name is (8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine.

Molecular Properties

Compound Name(8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine
PubChem CID105272049
Molecular FormulaC10H21F3N2O
Molecular Weight242.28 g/mol
Exact Mass242.16
IUPAC Name(8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine
SMILESCOC(C(C)C)C(CCCC(F)(F)F)NN
InChIInChI=1S/C10H21F3N2O/c1-7(2)9(16-3)8(15-14)5-4-6-10(11,12)13/h7-9,15H,4-6,14H2,1-3H3
InChIKeyLGYWQLORMGPZAR-UHFFFAOYSA-N
XLogP2.22
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.22
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-methyloctan-4-yl)hydrazine?
The IUPAC name of (8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine (CID 105272049) is (8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine.
What is the SMILES notation for (8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine?
The canonical SMILES for (8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine is COC(C(C)C)C(CCCC(F)(F)F)NN.
What is the InChIKey of (8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine?
The InChIKey is LGYWQLORMGPZAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21F3N2O/c1-7(2)9(16-3)8(15-14)5-4-6-10(11,12)13/h7-9,15H,4-6,14H2,1-3H3.
What are the key properties of (8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine?
(8,8,8-trifluoro-3-methoxy-2-methyloctan-4-yl)hydrazine has a molecular weight of 242.28 g/mol, XLogP of 2.22, 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-methoxy-2-methyloctan-4-yl)hydrazine is sourced from PubChem (CID 105272049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).