1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine

C9H12F2N2O — CID 82282452

IUPAC1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine
SMILESCN(N)CCOc1ccc(F)c(F)c1
InChIInChI=1S/C9H12F2N2O/c1-13(12)4-5-14-7-2-3-8(10)9(11)6-7/h2-3,6H,4-5,12H2,1H3
InChIKeyKSZSRVZSIJEMQA-UHFFFAOYSA-N
MW202.20 g/mol
LogP1.15
Rot. Bonds4

About 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine

1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine (PubChem CID 82282452) has the molecular formula C9H12F2N2O and a molecular weight of 202.20 g/mol. Its IUPAC name is 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine.

Molecular Properties

Compound Name1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine
PubChem CID82282452
Molecular FormulaC9H12F2N2O
Molecular Weight202.20 g/mol
Exact Mass202.09
IUPAC Name1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine
SMILESCN(N)CCOc1ccc(F)c(F)c1
InChIInChI=1S/C9H12F2N2O/c1-13(12)4-5-14-7-2-3-8(10)9(11)6-7/h2-3,6H,4-5,12H2,1H3
InChIKeyKSZSRVZSIJEMQA-UHFFFAOYSA-N
XLogP1.15
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.20
LogP ≤ 51.15
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine?
The IUPAC name of 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine (CID 82282452) is 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine.
What is the SMILES notation for 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine?
The canonical SMILES for 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine is CN(N)CCOc1ccc(F)c(F)c1.
What is the InChIKey of 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine?
The InChIKey is KSZSRVZSIJEMQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2N2O/c1-13(12)4-5-14-7-2-3-8(10)9(11)6-7/h2-3,6H,4-5,12H2,1H3.
What are the key properties of 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine?
1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine has a molecular weight of 202.20 g/mol, XLogP of 1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3,4-difluorophenoxy)ethyl]-1-methylhydrazine is sourced from PubChem (CID 82282452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).