(3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine

C12H25F3N2O — CID 105275060

IUPAC(3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine
SMILESCCOC(CC)(CC)C(CCCC(F)(F)F)NN
InChIInChI=1S/C12H25F3N2O/c1-4-11(5-2,18-6-3)10(17-16)8-7-9-12(13,14)15/h10,17H,4-9,16H2,1-3H3
InChIKeyBEPUIGFAIBLMEQ-UHFFFAOYSA-N
MW270.34 g/mol
LogP3.15
Rot. Bonds9

About (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine

(3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine (PubChem CID 105275060) has the molecular formula C12H25F3N2O and a molecular weight of 270.34 g/mol. Its IUPAC name is (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine.

Molecular Properties

Compound Name(3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine
PubChem CID105275060
Molecular FormulaC12H25F3N2O
Molecular Weight270.34 g/mol
Exact Mass270.19
IUPAC Name(3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine
SMILESCCOC(CC)(CC)C(CCCC(F)(F)F)NN
InChIInChI=1S/C12H25F3N2O/c1-4-11(5-2,18-6-3)10(17-16)8-7-9-12(13,14)15/h10,17H,4-9,16H2,1-3H3
InChIKeyBEPUIGFAIBLMEQ-UHFFFAOYSA-N
XLogP3.15
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(1,1,1-Trifluoro-6-methoxy-6-methylheptan-4-yl)hydrazine
CID 103025356
(8,8,8-Trifluoro-2-methoxy-2-methyloctan-4-yl)hydrazine
CID 103025443
(1,1,1-Trifluoro-7-methoxy-7-methyloctan-4-yl)hydrazine
CID 103026297
(1,1,1-Trifluoro-6-methoxy-6-methylheptan-3-yl)hydrazine
CID 103026460
[7-Methyl-1-(2,2,2-trifluoroethoxy)octan-3-yl]hydrazine
CID 103151446
[5-Ethyl-1-(2,2,2-trifluoroethoxy)nonan-3-yl]hydrazine
CID 103151536
[6-Methyl-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151646
[5-Methyl-1-(2,2,2-trifluoroethoxy)octan-3-yl]hydrazine
CID 103151652
[6-Methoxy-6-methyl-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151680
[1-(2,2-Difluoroethoxy)-7-methyloctan-3-yl]hydrazine
CID 103151765
[1-(2,2-Difluoroethoxy)-5-ethylnonan-3-yl]hydrazine
CID 103151857
[1-(2,2-Difluoroethoxy)-6-methylheptan-3-yl]hydrazine
CID 103151978

Frequently Asked Questions

What is the IUPAC name of (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine?
The IUPAC name of (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine (CID 105275060) is (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine.
What is the SMILES notation for (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine?
The canonical SMILES for (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine is CCOC(CC)(CC)C(CCCC(F)(F)F)NN.
What is the InChIKey of (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine?
The InChIKey is BEPUIGFAIBLMEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25F3N2O/c1-4-11(5-2,18-6-3)10(17-16)8-7-9-12(13,14)15/h10,17H,4-9,16H2,1-3H3.
What are the key properties of (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine?
(3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine has a molecular weight of 270.34 g/mol, XLogP of 3.15, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxy-3-ethyl-8,8,8-trifluorooctan-4-yl)hydrazine is sourced from PubChem (CID 105275060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).