4-(2,2-difluoroethoxy)butan-2-ylhydrazine

C6H14F2N2O — CID 103151928

IUPAC4-(2,2-difluoroethoxy)butan-2-ylhydrazine
SMILESCC(CCOCC(F)F)NN
InChIInChI=1S/C6H14F2N2O/c1-5(10-9)2-3-11-4-6(7)8/h5-6,10H,2-4,9H2,1H3
InChIKeyLNWAJOGLWSHSEV-UHFFFAOYSA-N
MW168.19 g/mol
LogP0.51
Rot. Bonds6

About 4-(2,2-difluoroethoxy)butan-2-ylhydrazine

4-(2,2-difluoroethoxy)butan-2-ylhydrazine (PubChem CID 103151928) has the molecular formula C6H14F2N2O and a molecular weight of 168.19 g/mol. Its IUPAC name is 4-(2,2-difluoroethoxy)butan-2-ylhydrazine.

Molecular Properties

Compound Name4-(2,2-difluoroethoxy)butan-2-ylhydrazine
PubChem CID103151928
Molecular FormulaC6H14F2N2O
Molecular Weight168.19 g/mol
Exact Mass168.11
IUPAC Name4-(2,2-difluoroethoxy)butan-2-ylhydrazine
SMILESCC(CCOCC(F)F)NN
InChIInChI=1S/C6H14F2N2O/c1-5(10-9)2-3-11-4-6(7)8/h5-6,10H,2-4,9H2,1H3
InChIKeyLNWAJOGLWSHSEV-UHFFFAOYSA-N
XLogP0.51
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.19
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(2,2-difluoroethoxy)butan-2-ylhydrazine?
The IUPAC name of 4-(2,2-difluoroethoxy)butan-2-ylhydrazine (CID 103151928) is 4-(2,2-difluoroethoxy)butan-2-ylhydrazine.
What is the SMILES notation for 4-(2,2-difluoroethoxy)butan-2-ylhydrazine?
The canonical SMILES for 4-(2,2-difluoroethoxy)butan-2-ylhydrazine is CC(CCOCC(F)F)NN.
What is the InChIKey of 4-(2,2-difluoroethoxy)butan-2-ylhydrazine?
The InChIKey is LNWAJOGLWSHSEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14F2N2O/c1-5(10-9)2-3-11-4-6(7)8/h5-6,10H,2-4,9H2,1H3.
What are the key properties of 4-(2,2-difluoroethoxy)butan-2-ylhydrazine?
4-(2,2-difluoroethoxy)butan-2-ylhydrazine has a molecular weight of 168.19 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-difluoroethoxy)butan-2-ylhydrazine is sourced from PubChem (CID 103151928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).