3,5,5-trimethylhexylhydrazine

C9H22N2 — CID 53414302

IUPAC3,5,5-trimethylhexylhydrazine
SMILESCC(CCNN)CC(C)(C)C
InChIInChI=1S/C9H22N2/c1-8(5-6-11-10)7-9(2,3)4/h8,11H,5-7,10H2,1-4H3
InChIKeyZDMDEKIBYAVUOC-UHFFFAOYSA-N
MW158.29 g/mol
LogP1.91
Rot. Bonds4

About 3,5,5-trimethylhexylhydrazine

3,5,5-trimethylhexylhydrazine (PubChem CID 53414302) has the molecular formula C9H22N2 and a molecular weight of 158.29 g/mol. Its IUPAC name is 3,5,5-trimethylhexylhydrazine.

Molecular Properties

Compound Name3,5,5-trimethylhexylhydrazine
PubChem CID53414302
Molecular FormulaC9H22N2
Molecular Weight158.29 g/mol
Exact Mass158.18
IUPAC Name3,5,5-trimethylhexylhydrazine
SMILESCC(CCNN)CC(C)(C)C
InChIInChI=1S/C9H22N2/c1-8(5-6-11-10)7-9(2,3)4/h8,11H,5-7,10H2,1-4H3
InChIKeyZDMDEKIBYAVUOC-UHFFFAOYSA-N
XLogP1.91
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.29
LogP ≤ 51.91
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'}

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Frequently Asked Questions

What is the IUPAC name of 3,5,5-trimethylhexylhydrazine?
The IUPAC name of 3,5,5-trimethylhexylhydrazine (CID 53414302) is 3,5,5-trimethylhexylhydrazine.
What is the SMILES notation for 3,5,5-trimethylhexylhydrazine?
The canonical SMILES for 3,5,5-trimethylhexylhydrazine is CC(CCNN)CC(C)(C)C.
What is the InChIKey of 3,5,5-trimethylhexylhydrazine?
The InChIKey is ZDMDEKIBYAVUOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2/c1-8(5-6-11-10)7-9(2,3)4/h8,11H,5-7,10H2,1-4H3.
What are the key properties of 3,5,5-trimethylhexylhydrazine?
3,5,5-trimethylhexylhydrazine has a molecular weight of 158.29 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5,5-trimethylhexylhydrazine is sourced from PubChem (CID 53414302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).