5-(difluoromethoxy)hept-5-en-2-ylhydrazine

C8H16F2N2O — CID 123926314

IUPAC5-(difluoromethoxy)hept-5-en-2-ylhydrazine
SMILESCC=C(CCC(C)NN)OC(F)F
InChIInChI=1S/C8H16F2N2O/c1-3-7(13-8(9)10)5-4-6(2)12-11/h3,6,8,12H,4-5,11H2,1-2H3
InChIKeyURJUHBKMJNLPQY-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.76
Rot. Bonds6

About 5-(difluoromethoxy)hept-5-en-2-ylhydrazine

5-(difluoromethoxy)hept-5-en-2-ylhydrazine (PubChem CID 123926314) has the molecular formula C8H16F2N2O and a molecular weight of 194.23 g/mol. Its IUPAC name is 5-(difluoromethoxy)hept-5-en-2-ylhydrazine.

Molecular Properties

Compound Name5-(difluoromethoxy)hept-5-en-2-ylhydrazine
PubChem CID123926314
Molecular FormulaC8H16F2N2O
Molecular Weight194.23 g/mol
Exact Mass194.12
IUPAC Name5-(difluoromethoxy)hept-5-en-2-ylhydrazine
SMILESCC=C(CCC(C)NN)OC(F)F
InChIInChI=1S/C8H16F2N2O/c1-3-7(13-8(9)10)5-4-6(2)12-11/h3,6,8,12H,4-5,11H2,1-2H3
InChIKeyURJUHBKMJNLPQY-UHFFFAOYSA-N
XLogP1.76
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', '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 5-(difluoromethoxy)hept-5-en-2-ylhydrazine?
The IUPAC name of 5-(difluoromethoxy)hept-5-en-2-ylhydrazine (CID 123926314) is 5-(difluoromethoxy)hept-5-en-2-ylhydrazine.
What is the SMILES notation for 5-(difluoromethoxy)hept-5-en-2-ylhydrazine?
The canonical SMILES for 5-(difluoromethoxy)hept-5-en-2-ylhydrazine is CC=C(CCC(C)NN)OC(F)F.
What is the InChIKey of 5-(difluoromethoxy)hept-5-en-2-ylhydrazine?
The InChIKey is URJUHBKMJNLPQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16F2N2O/c1-3-7(13-8(9)10)5-4-6(2)12-11/h3,6,8,12H,4-5,11H2,1-2H3.
What are the key properties of 5-(difluoromethoxy)hept-5-en-2-ylhydrazine?
5-(difluoromethoxy)hept-5-en-2-ylhydrazine has a molecular weight of 194.23 g/mol, XLogP of 1.76, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethoxy)hept-5-en-2-ylhydrazine is sourced from PubChem (CID 123926314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).