(1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine

C8H15F3N2 — CID 105205974

IUPAC(1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine
SMILESC=C(C)CCC(CC(F)(F)F)NN
InChIInChI=1S/C8H15F3N2/c1-6(2)3-4-7(13-12)5-8(9,10)11/h7,13H,1,3-5,12H2,2H3
InChIKeyBSVOTFOHHPYJIY-UHFFFAOYSA-N
MW196.22 g/mol
LogP2.13
Rot. Bonds5

About (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine

(1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine (PubChem CID 105205974) has the molecular formula C8H15F3N2 and a molecular weight of 196.22 g/mol. Its IUPAC name is (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine.

Molecular Properties

Compound Name(1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine
PubChem CID105205974
Molecular FormulaC8H15F3N2
Molecular Weight196.22 g/mol
Exact Mass196.12
IUPAC Name(1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine
SMILESC=C(C)CCC(CC(F)(F)F)NN
InChIInChI=1S/C8H15F3N2/c1-6(2)3-4-7(13-12)5-8(9,10)11/h7,13H,1,3-5,12H2,2H3
InChIKeyBSVOTFOHHPYJIY-UHFFFAOYSA-N
XLogP2.13
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 52.13
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

[(5R)-5-fluoro-2-methylideneheptyl]hydrazine
CID 89952073
[1,1,1-Trifluoro-5-methyl-2-(trifluoromethyl)hex-5-en-3-yl]hydrazine
CID 103312851
[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-Trifluorooct-7-en-3-ylhydrazine
CID 105205883
(1,1,1-Trifluoro-5-methylhex-5-en-3-yl)hydrazine
CID 105206128
(1,1,1-Trifluoro-5-methylideneheptan-3-yl)hydrazine
CID 105206136
(5,5,5-Trifluoro-2-methylpent-1-en-3-yl)hydrazine
CID 105206138
1,1,1-Trifluorohept-6-en-2-ylhydrazine
CID 105215585
(1,1,1-Trifluoro-5-methylhex-5-en-2-yl)hydrazine
CID 105215672
(1,1,1-Trifluoro-4-methylpent-4-en-2-yl)hydrazine
CID 105215814
(1,1,1-Trifluoro-4-methylidenehexan-2-yl)hydrazine
CID 105215821

Frequently Asked Questions

What is the IUPAC name of (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine?
The IUPAC name of (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine (CID 105205974) is (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine.
What is the SMILES notation for (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine?
The canonical SMILES for (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine is C=C(C)CCC(CC(F)(F)F)NN.
What is the InChIKey of (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine?
The InChIKey is BSVOTFOHHPYJIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F3N2/c1-6(2)3-4-7(13-12)5-8(9,10)11/h7,13H,1,3-5,12H2,2H3.
What are the key properties of (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine?
(1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine has a molecular weight of 196.22 g/mol, XLogP of 2.13, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1,1-trifluoro-6-methylhept-6-en-3-yl)hydrazine is sourced from PubChem (CID 105205974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).