[1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine

C13H28F2N2O — CID 103151857

IUPAC[1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine
SMILESCCCCC(CC)CC(CCOCC(F)F)NN
InChIInChI=1S/C13H28F2N2O/c1-3-5-6-11(4-2)9-12(17-16)7-8-18-10-13(14)15/h11-13,17H,3-10,16H2,1-2H3
InChIKeyMCNNIEIRNJEHKH-UHFFFAOYSA-N
MW266.38 g/mol
LogP3.10
Rot. Bonds12

About [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine

[1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine (PubChem CID 103151857) has the molecular formula C13H28F2N2O and a molecular weight of 266.38 g/mol. Its IUPAC name is [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine
PubChem CID103151857
Molecular FormulaC13H28F2N2O
Molecular Weight266.38 g/mol
Exact Mass266.22
IUPAC Name[1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine
SMILESCCCCC(CC)CC(CCOCC(F)F)NN
InChIInChI=1S/C13H28F2N2O/c1-3-5-6-11(4-2)9-12(17-16)7-8-18-10-13(14)15/h11-13,17H,3-10,16H2,1-2H3
InChIKeyMCNNIEIRNJEHKH-UHFFFAOYSA-N
XLogP3.10
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(8,8,8-Trifluoro-2-methoxy-2-methyloctan-4-yl)hydrazine
CID 103025443
[1-(4,4-Difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine
CID 103026280
5-Methyl-1-(2,2,2-trifluoroethoxy)heptan-3-amine
CID 103147984
5-Methyl-1-(2,2,2-trifluoroethoxy)octan-3-amine
CID 103148014
5-Ethyl-1-(2,2,2-trifluoroethoxy)heptan-3-amine
CID 103148109
5-Ethyl-1-(2,2,2-trifluoroethoxy)nonan-3-amine
CID 103148177
1-(2,2-Difluoroethoxy)-5-methylheptan-3-amine
CID 103148839
1-(2,2-Difluoroethoxy)-5-methyloctan-3-amine
CID 103148880
1-(2,2-Difluoroethoxy)-5-ethylheptan-3-amine
CID 103149002
1-(2,2-Difluoroethoxy)-5-ethylnonan-3-amine
CID 103149078
[1-Cycloheptyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151444
[7-Methyl-1-(2,2,2-trifluoroethoxy)octan-3-yl]hydrazine
CID 103151446

Frequently Asked Questions

What is the IUPAC name of [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine?
The IUPAC name of [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine (CID 103151857) is [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine.
What is the SMILES notation for [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine?
The canonical SMILES for [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine is CCCCC(CC)CC(CCOCC(F)F)NN.
What is the InChIKey of [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine?
The InChIKey is MCNNIEIRNJEHKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28F2N2O/c1-3-5-6-11(4-2)9-12(17-16)7-8-18-10-13(14)15/h11-13,17H,3-10,16H2,1-2H3.
What are the key properties of [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine?
[1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine has a molecular weight of 266.38 g/mol, XLogP of 3.10, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,2-difluoroethoxy)-5-ethylnonan-3-yl]hydrazine is sourced from PubChem (CID 103151857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).