[3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine

C12H20F6N2O — CID 103312928

IUPAC[3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine
SMILESCC1(C)CC(C(NN)C(C(F)(F)F)C(F)(F)F)C(C)(C)O1
InChIInChI=1S/C12H20F6N2O/c1-9(2)5-6(10(3,4)21-9)7(20-19)8(11(13,14)15)12(16,17)18/h6-8,20H,5,19H2,1-4H3
InChIKeyKSEXJFPYMCQVFT-UHFFFAOYSA-N
MW322.29 g/mol
LogP3.15
Rot. Bonds3

About [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine

[3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine (PubChem CID 103312928) has the molecular formula C12H20F6N2O and a molecular weight of 322.29 g/mol. Its IUPAC name is [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine.

Molecular Properties

Compound Name[3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine
PubChem CID103312928
Molecular FormulaC12H20F6N2O
Molecular Weight322.29 g/mol
Exact Mass322.15
IUPAC Name[3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine
SMILESCC1(C)CC(C(NN)C(C(F)(F)F)C(F)(F)F)C(C)(C)O1
InChIInChI=1S/C12H20F6N2O/c1-9(2)5-6(10(3,4)21-9)7(20-19)8(11(13,14)15)12(16,17)18/h6-8,20H,5,19H2,1-4H3
InChIKeyKSEXJFPYMCQVFT-UHFFFAOYSA-N
XLogP3.15
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.29
LogP ≤ 53.15
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 [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine?
The IUPAC name of [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine (CID 103312928) is [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine.
What is the SMILES notation for [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine?
The canonical SMILES for [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine is CC1(C)CC(C(NN)C(C(F)(F)F)C(F)(F)F)C(C)(C)O1.
What is the InChIKey of [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine?
The InChIKey is KSEXJFPYMCQVFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20F6N2O/c1-9(2)5-6(10(3,4)21-9)7(20-19)8(11(13,14)15)12(16,17)18/h6-8,20H,5,19H2,1-4H3.
What are the key properties of [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine?
[3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine has a molecular weight of 322.29 g/mol, XLogP of 3.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3,3,3-trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)-2-(trifluoromethyl)propyl]hydrazine is sourced from PubChem (CID 103312928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).