1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine

C14H22BrClN2 — CID 105335285

IUPAC1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine
SMILESCCCCCCC(Cc1ccc(Br)cc1Cl)NN
InChIInChI=1S/C14H22BrClN2/c1-2-3-4-5-6-13(18-17)9-11-7-8-12(15)10-14(11)16/h7-8,10,13,18H,2-6,9,17H2,1H3
InChIKeyCIZHEEJQSSRCMI-UHFFFAOYSA-N
MW333.70 g/mol
LogP4.45
Rot. Bonds8

About 1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine

1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine (PubChem CID 105335285) has the molecular formula C14H22BrClN2 and a molecular weight of 333.70 g/mol. Its IUPAC name is 1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine.

Molecular Properties

Compound Name1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine
PubChem CID105335285
Molecular FormulaC14H22BrClN2
Molecular Weight333.70 g/mol
Exact Mass332.07
IUPAC Name1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine
SMILESCCCCCCC(Cc1ccc(Br)cc1Cl)NN
InChIInChI=1S/C14H22BrClN2/c1-2-3-4-5-6-13(18-17)9-11-7-8-12(15)10-14(11)16/h7-8,10,13,18H,2-6,9,17H2,1H3
InChIKeyCIZHEEJQSSRCMI-UHFFFAOYSA-N
XLogP4.45
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.70
LogP ≤ 54.45
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(4-bromo-2-chlorophenyl)-4-methoxybutan-2-yl]hydrazine
CID 105206418
1-(2,5-dichlorophenyl)undecan-2-ylhydrazine
CID 105309812
[1-(4-bromo-2-chlorophenyl)-5-thiophen-2-ylpentan-2-yl]hydrazine
CID 105335240
1-(2-chloro-4-methylphenyl)-N-methyloctan-2-amine
CID 106867862
1-(5-chloro-2-fluorophenyl)octan-2-ylhydrazine
CID 103053822
1-(2,3-dichlorophenyl)undecan-2-ylhydrazine
CID 107312866
1-(5-chloro-2-fluorophenyl)decan-2-ylhydrazine
CID 103053761
[1-(4-bromo-2-chlorophenyl)-3-methylhexan-2-yl]hydrazine
CID 105335234
1-(3-bromophenyl)heptan-2-ylhydrazine
CID 105202849
[1-(4-bromo-2-chlorophenyl)-3-(2,5-dimethylphenyl)propan-2-yl]hydrazine
CID 105335288
N-[(4-bromo-2-chlorophenyl)methyl]octan-4-amine
CID 114138050
[1-(4-bromo-2-chlorophenyl)-3-(3-ethoxycyclobutyl)propan-2-yl]hydrazine
CID 103170787

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine?
The IUPAC name of 1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine (CID 105335285) is 1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine.
What is the SMILES notation for 1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine?
The canonical SMILES for 1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine is CCCCCCC(Cc1ccc(Br)cc1Cl)NN.
What is the InChIKey of 1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine?
The InChIKey is CIZHEEJQSSRCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22BrClN2/c1-2-3-4-5-6-13(18-17)9-11-7-8-12(15)10-14(11)16/h7-8,10,13,18H,2-6,9,17H2,1H3.
What are the key properties of 1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine?
1-(4-bromo-2-chlorophenyl)octan-2-ylhydrazine has a molecular weight of 333.70 g/mol, XLogP of 4.45, 8 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)octan-2-ylhydrazine is sourced from PubChem (CID 105335285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).