1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine

C9H10BrClN2 — CID 105318088

IUPAC1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine
SMILESC=CC(NN)c1ccc(Br)cc1Cl
InChIInChI=1S/C9H10BrClN2/c1-2-9(13-12)7-4-3-6(10)5-8(7)11/h2-5,9,13H,1,12H2
InChIKeyMSBWHVITHKFJLZ-UHFFFAOYSA-N
MW261.55 g/mol
LogP2.79
Rot. Bonds3

About 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine

1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine (PubChem CID 105318088) has the molecular formula C9H10BrClN2 and a molecular weight of 261.55 g/mol. Its IUPAC name is 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine.

Molecular Properties

Compound Name1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine
PubChem CID105318088
Molecular FormulaC9H10BrClN2
Molecular Weight261.55 g/mol
Exact Mass259.97
IUPAC Name1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine
SMILESC=CC(NN)c1ccc(Br)cc1Cl
InChIInChI=1S/C9H10BrClN2/c1-2-9(13-12)7-4-3-6(10)5-8(7)11/h2-5,9,13H,1,12H2
InChIKeyMSBWHVITHKFJLZ-UHFFFAOYSA-N
XLogP2.79
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.55
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(4-bromo-2-chlorophenyl)but-3-enylhydrazine
CID 105289666
(1R)-1-(5-bromo-2-chlorophenyl)prop-2-en-1-amine
CID 130853844
[1-(4-bromo-2-chlorophenyl)-4,4,4-trifluorobutyl]hydrazine
CID 105313950
[1-(4-bromo-2-chlorophenyl)-2-(3,4-dichlorophenyl)ethyl]hydrazine
CID 105296864
[(4-bromo-2-chlorophenyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105304998
[(4-bromo-2-chlorophenyl)-(2,5-difluorophenyl)methyl]hydrazine
CID 105303405
(4-bromo-2-chlorophenyl)-(4-bromophenyl)methanamine
CID 43805136
1-(4-bromo-2-chlorophenyl)-2,2-dimethylpropan-1-amine
CID 112705508
(2R)-2-(4-bromo-2-chlorophenyl)-2-fluoroethanamine
CID 175839043
[1-(4-bromo-2-chlorophenyl)-3-methylsulfonylpropyl]hydrazine
CID 114985187
[(4-bromo-2-chlorophenyl)-(2,6-dimethoxyphenyl)methyl]hydrazine
CID 105341281
[(4-bromo-2-chlorophenyl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313337

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine?
The IUPAC name of 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine (CID 105318088) is 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine.
What is the SMILES notation for 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine?
The canonical SMILES for 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine is C=CC(NN)c1ccc(Br)cc1Cl.
What is the InChIKey of 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine?
The InChIKey is MSBWHVITHKFJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrClN2/c1-2-9(13-12)7-4-3-6(10)5-8(7)11/h2-5,9,13H,1,12H2.
What are the key properties of 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine?
1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine has a molecular weight of 261.55 g/mol, XLogP of 2.79, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromo-2-chlorophenyl)prop-2-enylhydrazine is sourced from PubChem (CID 105318088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).