ethane;3,3,4,4,4-pentafluorobutylhydrazine

C6H13F5N2 — CID 144862694

IUPACethane;3,3,4,4,4-pentafluorobutylhydrazine
SMILESCC.NNCCC(F)(F)C(F)(F)F
InChIInChI=1S/C4H7F5N2.C2H6/c5-3(6,1-2-11-10)4(7,8)9;1-2/h11H,1-2,10H2;1-2H3
InChIKeyOHJDMNBUSHZWML-UHFFFAOYSA-N
MW208.17 g/mol
LogP2.06
Rot. Bonds3

About ethane;3,3,4,4,4-pentafluorobutylhydrazine

ethane;3,3,4,4,4-pentafluorobutylhydrazine (PubChem CID 144862694) has the molecular formula C6H13F5N2 and a molecular weight of 208.17 g/mol. Its IUPAC name is ethane;3,3,4,4,4-pentafluorobutylhydrazine.

Molecular Properties

Compound Nameethane;3,3,4,4,4-pentafluorobutylhydrazine
PubChem CID144862694
Molecular FormulaC6H13F5N2
Molecular Weight208.17 g/mol
Exact Mass208.10
IUPAC Nameethane;3,3,4,4,4-pentafluorobutylhydrazine
SMILESCC.NNCCC(F)(F)C(F)(F)F
InChIInChI=1S/C4H7F5N2.C2H6/c5-3(6,1-2-11-10)4(7,8)9;1-2/h11H,1-2,10H2;1-2H3
InChIKeyOHJDMNBUSHZWML-UHFFFAOYSA-N
XLogP2.06
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.17
LogP ≤ 52.06
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'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

3,3,4,4-Tetrafluorobutan-2-ylhydrazine
CID 19010935
(4,4,4-Trifluorobutyl)-hydrazine hydrochloride (1:1)
CID 154804837
(4,4-Difluorobutyl)hydrazine dihydrochloride
CID 146082170
(3,3-Difluoropentyl)hydrazine dihydrochloride
CID 165911844
(3,3,4,4,4-Pentafluorobutyl)hydrazine dihydrochloride
CID 170914154
2-Fluorobutylhydrazine
CID 13278470
(4,4,4-Trifluorobutyl)hydrazine
CID 57626237
Methanidyl-(3,3,3-trifluoropropylamino)azanium
CID 59074018
1-Methyl-2-(3,3,3-trifluoropropyl)hydrazine
CID 72508024
4,4,4-Trifluorobutylhydrazine;dihydrochloride
CID 87096200
1-Fluorobutylhydrazine
CID 87241367
4,4,4-Trifluorobutylhydrazine;hydrate;hydrochloride
CID 87267644

Frequently Asked Questions

What is the IUPAC name of ethane;3,3,4,4,4-pentafluorobutylhydrazine?
The IUPAC name of ethane;3,3,4,4,4-pentafluorobutylhydrazine (CID 144862694) is ethane;3,3,4,4,4-pentafluorobutylhydrazine.
What is the SMILES notation for ethane;3,3,4,4,4-pentafluorobutylhydrazine?
The canonical SMILES for ethane;3,3,4,4,4-pentafluorobutylhydrazine is CC.NNCCC(F)(F)C(F)(F)F.
What is the InChIKey of ethane;3,3,4,4,4-pentafluorobutylhydrazine?
The InChIKey is OHJDMNBUSHZWML-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7F5N2.C2H6/c5-3(6,1-2-11-10)4(7,8)9;1-2/h11H,1-2,10H2;1-2H3.
What are the key properties of ethane;3,3,4,4,4-pentafluorobutylhydrazine?
ethane;3,3,4,4,4-pentafluorobutylhydrazine has a molecular weight of 208.17 g/mol, XLogP of 2.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3,3,4,4,4-pentafluorobutylhydrazine is sourced from PubChem (CID 144862694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).