[5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine

C7H10F6N2 — CID 103312853

IUPAC[5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine
SMILESC=C(C)C(NN)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H10F6N2/c1-3(2)4(15-14)5(6(8,9)10)7(11,12)13/h4-5,15H,1,14H2,2H3
InChIKeySMSCLOQIHRFSED-UHFFFAOYSA-N
MW236.16 g/mol
LogP2.14
Rot. Bonds3

About [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine

[5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine (PubChem CID 103312853) has the molecular formula C7H10F6N2 and a molecular weight of 236.16 g/mol. Its IUPAC name is [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine.

Molecular Properties

Compound Name[5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine
PubChem CID103312853
Molecular FormulaC7H10F6N2
Molecular Weight236.16 g/mol
Exact Mass236.07
IUPAC Name[5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine
SMILESC=C(C)C(NN)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C7H10F6N2/c1-3(2)4(15-14)5(6(8,9)10)7(11,12)13/h4-5,15H,1,14H2,2H3
InChIKeySMSCLOQIHRFSED-UHFFFAOYSA-N
XLogP2.14
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.16
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1,1,1-Trifluoro-2-(trifluoromethyl)hex-5-en-3-yl]hydrazine
CID 103312738
[5,5,5-Trifluoro-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine
CID 103312845
[1,1,1-Trifluoro-5-methyl-2-(trifluoromethyl)hex-5-en-3-yl]hydrazine
CID 103312851
[1,1,1-Trifluoro-5-methyl-2-(trifluoromethyl)hex-4-en-3-yl]hydrazine
CID 103312852
[1,1,1-Trifluoro-5-methylidene-2-(trifluoromethyl)heptan-3-yl]hydrazine
CID 103312854
[1,1,1-Trifluoro-6-methyl-2-(trifluoromethyl)hept-6-en-3-yl]hydrazine
CID 103312910
(1,1,1-Trifluoro-5-methylhex-5-en-3-yl)hydrazine
CID 105206128
(5,5,5-Trifluoro-2-methylpent-1-en-3-yl)hydrazine
CID 105206138
(1,1,1-Trifluoro-4-methylpent-4-en-2-yl)hydrazine
CID 105215814
(6,6,6-Trifluoro-2-methylhex-1-en-3-yl)hydrazine
CID 105249076
(1,1-Difluoro-4-methylpent-4-en-2-yl)hydrazine
CID 105265225
(1,1-Difluoro-3-methylbut-3-en-2-yl)hydrazine
CID 105265234

Frequently Asked Questions

What is the IUPAC name of [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine?
The IUPAC name of [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine (CID 103312853) is [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine.
What is the SMILES notation for [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine?
The canonical SMILES for [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine is C=C(C)C(NN)C(C(F)(F)F)C(F)(F)F.
What is the InChIKey of [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine?
The InChIKey is SMSCLOQIHRFSED-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F6N2/c1-3(2)4(15-14)5(6(8,9)10)7(11,12)13/h4-5,15H,1,14H2,2H3.
What are the key properties of [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine?
[5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine has a molecular weight of 236.16 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5,5,5-trifluoro-2-methyl-4-(trifluoromethyl)pent-1-en-3-yl]hydrazine is sourced from PubChem (CID 103312853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).