[4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine

C6H10F6N2O — CID 103312859

IUPAC[4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine
SMILESCOCC(NN)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H10F6N2O/c1-15-2-3(14-13)4(5(7,8)9)6(10,11)12/h3-4,14H,2,13H2,1H3
InChIKeyUHZSNBIGWAVZMW-UHFFFAOYSA-N
MW240.15 g/mol
LogP1.21
Rot. Bonds4

About [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine

[4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine (PubChem CID 103312859) has the molecular formula C6H10F6N2O and a molecular weight of 240.15 g/mol. Its IUPAC name is [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine
PubChem CID103312859
Molecular FormulaC6H10F6N2O
Molecular Weight240.15 g/mol
Exact Mass240.07
IUPAC Name[4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine
SMILESCOCC(NN)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H10F6N2O/c1-15-2-3(14-13)4(5(7,8)9)6(10,11)12/h3-4,14H,2,13H2,1H3
InChIKeyUHZSNBIGWAVZMW-UHFFFAOYSA-N
XLogP1.21
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.15
LogP ≤ 51.21
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 [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine?
The IUPAC name of [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine (CID 103312859) is [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine.
What is the SMILES notation for [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine?
The canonical SMILES for [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine is COCC(NN)C(C(F)(F)F)C(F)(F)F.
What is the InChIKey of [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine?
The InChIKey is UHZSNBIGWAVZMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F6N2O/c1-15-2-3(14-13)4(5(7,8)9)6(10,11)12/h3-4,14H,2,13H2,1H3.
What are the key properties of [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine?
[4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine has a molecular weight of 240.15 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4,4,4-trifluoro-1-methoxy-3-(trifluoromethyl)butan-2-yl]hydrazine is sourced from PubChem (CID 103312859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).