(1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine

C13H27F3N2 — CID 105328893

IUPAC(1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine
SMILESCC(CC(CCCC(F)(F)F)NN)CC(C)(C)C
InChIInChI=1S/C13H27F3N2/c1-10(9-12(2,3)4)8-11(18-17)6-5-7-13(14,15)16/h10-11,18H,5-9,17H2,1-4H3
InChIKeyPKZBRFXWACTEAO-UHFFFAOYSA-N
MW268.37 g/mol
LogP4.01
Rot. Bonds7

About (1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine

(1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine (PubChem CID 105328893) has the molecular formula C13H27F3N2 and a molecular weight of 268.37 g/mol. Its IUPAC name is (1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine.

Molecular Properties

Compound Name(1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine
PubChem CID105328893
Molecular FormulaC13H27F3N2
Molecular Weight268.37 g/mol
Exact Mass268.21
IUPAC Name(1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine
SMILESCC(CC(CCCC(F)(F)F)NN)CC(C)(C)C
InChIInChI=1S/C13H27F3N2/c1-10(9-12(2,3)4)8-11(18-17)6-5-7-13(14,15)16/h10-11,18H,5-9,17H2,1-4H3
InChIKeyPKZBRFXWACTEAO-UHFFFAOYSA-N
XLogP4.01
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.37
LogP ≤ 54.01
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-7,9,9-trimethyldecan-5-yl)hydrazine?
The IUPAC name of (1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine (CID 105328893) is (1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine.
What is the SMILES notation for (1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine?
The canonical SMILES for (1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine is CC(CC(CCCC(F)(F)F)NN)CC(C)(C)C.
What is the InChIKey of (1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine?
The InChIKey is PKZBRFXWACTEAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27F3N2/c1-10(9-12(2,3)4)8-11(18-17)6-5-7-13(14,15)16/h10-11,18H,5-9,17H2,1-4H3.
What are the key properties of (1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine?
(1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine has a molecular weight of 268.37 g/mol, XLogP of 4.01, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1,1-trifluoro-7,9,9-trimethyldecan-5-yl)hydrazine is sourced from PubChem (CID 105328893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).