[1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine

C9H12BrClN2O — CID 105321658

IUPAC[1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine
SMILESCOCC(NN)c1ccc(Br)c(Cl)c1
InChIInChI=1S/C9H12BrClN2O/c1-14-5-9(13-12)6-2-3-7(10)8(11)4-6/h2-4,9,13H,5,12H2,1H3
InChIKeyYHBJHJQSBOLFNL-UHFFFAOYSA-N
MW279.57 g/mol
LogP2.25
Rot. Bonds4

About [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine

[1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine (PubChem CID 105321658) has the molecular formula C9H12BrClN2O and a molecular weight of 279.57 g/mol. Its IUPAC name is [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine
PubChem CID105321658
Molecular FormulaC9H12BrClN2O
Molecular Weight279.57 g/mol
Exact Mass277.98
IUPAC Name[1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine
SMILESCOCC(NN)c1ccc(Br)c(Cl)c1
InChIInChI=1S/C9H12BrClN2O/c1-14-5-9(13-12)6-2-3-7(10)8(11)4-6/h2-4,9,13H,5,12H2,1H3
InChIKeyYHBJHJQSBOLFNL-UHFFFAOYSA-N
XLogP2.25
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.57
LogP ≤ 52.25
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-(4-bromo-3-chlorophenyl)hex-4-ynylhydrazine
CID 105335018
1-(4-bromo-3-chlorophenyl)undecylhydrazine
CID 105298371
[1-(4-bromo-3-chlorophenyl)-2-thiophen-2-ylethyl]hydrazine
CID 105295531
[1-(3,4-difluorophenyl)-2-methoxyethyl]hydrazine
CID 105197185
[1-(4-bromo-3-chlorophenyl)-2-pyridin-4-ylethyl]hydrazine
CID 105317536
[1-(4-bromo-3-chlorophenyl)-2-(3,5-difluorophenyl)ethyl]hydrazine
CID 105413118
[1-(4-bromo-3-chlorophenyl)-3-cyclopropylpropyl]hydrazine
CID 105315140
[1-(4-bromo-3-chlorophenyl)-2-(2,5-dimethylphenyl)ethyl]hydrazine
CID 105287745
[1-(4-bromo-3-chlorophenyl)-2-(2-bromo-5-fluorophenyl)ethyl]hydrazine
CID 105297052
[1-(4-bromo-3-chlorophenyl)-2-(2,6-difluorophenyl)ethyl]hydrazine
CID 105342880
[1-(3,4-dichlorophenyl)-2-propan-2-yloxyethyl]hydrazine
CID 105257205
1-(4-bromo-3-chlorophenyl)-2-ethoxy-N-ethylethanamine
CID 105007854

Frequently Asked Questions

What is the IUPAC name of [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine?
The IUPAC name of [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine (CID 105321658) is [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine.
What is the SMILES notation for [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine?
The canonical SMILES for [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine is COCC(NN)c1ccc(Br)c(Cl)c1.
What is the InChIKey of [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine?
The InChIKey is YHBJHJQSBOLFNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12BrClN2O/c1-14-5-9(13-12)6-2-3-7(10)8(11)4-6/h2-4,9,13H,5,12H2,1H3.
What are the key properties of [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine?
[1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine has a molecular weight of 279.57 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-bromo-3-chlorophenyl)-2-methoxyethyl]hydrazine is sourced from PubChem (CID 105321658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).