1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine

C14H20BrClN2 — CID 107997433

IUPAC1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1ccc(Cl)cc1Br
InChIInChI=1S/C14H20BrClN2/c1-2-3-4-5-6-7-14(18-17)12-9-8-11(16)10-13(12)15/h2,8-10,14,18H,1,3-7,17H2
InChIKeyQEAYZVZMTURNAQ-UHFFFAOYSA-N
MW331.69 g/mol
LogP4.74
Rot. Bonds8

About 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine

1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine (PubChem CID 107997433) has the molecular formula C14H20BrClN2 and a molecular weight of 331.69 g/mol. Its IUPAC name is 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine.

Molecular Properties

Compound Name1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine
PubChem CID107997433
Molecular FormulaC14H20BrClN2
Molecular Weight331.69 g/mol
Exact Mass330.05
IUPAC Name1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine
SMILESC=CCCCCCC(NN)c1ccc(Cl)cc1Br
InChIInChI=1S/C14H20BrClN2/c1-2-3-4-5-6-7-14(18-17)12-9-8-11(16)10-13(12)15/h2,8-10,14,18H,1,3-7,17H2
InChIKeyQEAYZVZMTURNAQ-UHFFFAOYSA-N
XLogP4.74
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.69
LogP ≤ 54.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-(2,4-dibromophenyl)hex-5-enylhydrazine
CID 107948272
1-(5-chloro-2-fluorophenyl)hex-5-enylhydrazine
CID 105280013
1-(5-chloro-2-methylphenyl)hex-5-enylhydrazine
CID 105311435
1-(4-bromo-2-methoxyphenyl)oct-7-enylhydrazine
CID 107012919
1-(2-bromo-3,4-difluorophenyl)hex-5-enylhydrazine
CID 107541153
1-(2-bromofuran-3-yl)oct-7-enylhydrazine
CID 107012785
1-(2,5-dichlorothiophen-3-yl)oct-7-enylhydrazine
CID 107970721
1-(2-bromo-4-methylphenyl)pent-4-enylhydrazine
CID 105311522
(1R)-1-(2-bromo-4-chlorophenyl)pent-4-en-1-amine;hydrochloride
CID 171203790
1-(3-chloro-4-pyridinyl)oct-7-enylhydrazine
CID 107012984
1-(4-chloro-2-fluorophenyl)-N-ethyloct-7-en-1-amine
CID 107009080
[1-(2-bromo-4-chlorophenyl)-2-cyclobutylethyl]hydrazine
CID 107997064

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine?
The IUPAC name of 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine (CID 107997433) is 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine.
What is the SMILES notation for 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine?
The canonical SMILES for 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine is C=CCCCCCC(NN)c1ccc(Cl)cc1Br.
What is the InChIKey of 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine?
The InChIKey is QEAYZVZMTURNAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20BrClN2/c1-2-3-4-5-6-7-14(18-17)12-9-8-11(16)10-13(12)15/h2,8-10,14,18H,1,3-7,17H2.
What are the key properties of 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine?
1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine has a molecular weight of 331.69 g/mol, XLogP of 4.74, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromo-4-chlorophenyl)oct-7-enylhydrazine is sourced from PubChem (CID 107997433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).