[1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine

C10H11Cl2F3N2 — CID 105206142

IUPAC[1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
SMILESNNC(Cc1cc(Cl)ccc1Cl)CC(F)(F)F
InChIInChI=1S/C10H11Cl2F3N2/c11-7-1-2-9(12)6(3-7)4-8(17-16)5-10(13,14)15/h1-3,8,17H,4-5,16H2
InChIKeyQAOKHWGZAFDBJV-UHFFFAOYSA-N
MW287.11 g/mol
LogP3.32
Rot. Bonds4

About [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine

[1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine (PubChem CID 105206142) has the molecular formula C10H11Cl2F3N2 and a molecular weight of 287.11 g/mol. Its IUPAC name is [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
PubChem CID105206142
Molecular FormulaC10H11Cl2F3N2
Molecular Weight287.11 g/mol
Exact Mass286.03
IUPAC Name[1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
SMILESNNC(Cc1cc(Cl)ccc1Cl)CC(F)(F)F
InChIInChI=1S/C10H11Cl2F3N2/c11-7-1-2-9(12)6(3-7)4-8(17-16)5-10(13,14)15/h1-3,8,17H,4-5,16H2
InChIKeyQAOKHWGZAFDBJV-UHFFFAOYSA-N
XLogP3.32
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.11
LogP ≤ 53.32
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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Related Compounds

[1-(4-chloro-3-fluorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
CID 107894856
[1-(4-chlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
CID 105206174
[1-(4-chlorophenoxy)-3-(2,5-dichlorophenyl)propan-2-yl]hydrazine
CID 105309838
[1-(2,5-dichlorophenyl)-3,3-dimethylpentan-2-yl]hydrazine
CID 105309938
1-(2,5-dichlorophenyl)undecan-2-ylhydrazine
CID 105309812
3-(2,5-dichlorophenyl)-1,1,1-trifluoropropan-2-amine
CID 115862976
[1-(5-chloro-2-fluorophenyl)-2-(2,5-dichlorophenyl)ethyl]hydrazine
CID 105280226
[1-(2,5-dichlorophenyl)-3-(3-methylphenyl)propan-2-yl]hydrazine
CID 105209040
[1-(2,5-dimethylphenyl)-4,4,4-trifluorobutan-2-yl]hydrazine
CID 105205901
[1-cyclopentylsulfanyl-3-(2,5-dichlorophenyl)propan-2-yl]hydrazine
CID 105227623
[1-(5-chloro-2-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 103053888
[2-(2,5-dichlorophenyl)-1-(3,5-dichlorophenyl)ethyl]hydrazine
CID 105309863

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine?
The IUPAC name of [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine (CID 105206142) is [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine.
What is the SMILES notation for [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine?
The canonical SMILES for [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine is NNC(Cc1cc(Cl)ccc1Cl)CC(F)(F)F.
What is the InChIKey of [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine?
The InChIKey is QAOKHWGZAFDBJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl2F3N2/c11-7-1-2-9(12)6(3-7)4-8(17-16)5-10(13,14)15/h1-3,8,17H,4-5,16H2.
What are the key properties of [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine?
[1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine has a molecular weight of 287.11 g/mol, XLogP of 3.32, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dichlorophenyl)-4,4,4-trifluorobutan-2-yl]hydrazine is sourced from PubChem (CID 105206142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).