bromo-hexyl-trimethyl-λ5-phosphane

C9H22BrP — CID 140527909

IUPACbromo-hexyl-trimethyl-λ5-phosphane
SMILESCCCCCCP(C)(C)(C)Br
InChIInChI=1S/C9H22BrP/c1-5-6-7-8-9-11(2,3,4)10/h5-9H2,1-4H3
InChIKeyVMYLEJAFMKTLQQ-UHFFFAOYSA-N
MW241.15 g/mol
LogP4.32
Rot. Bonds5

About bromo-hexyl-trimethyl-λ5-phosphane

bromo-hexyl-trimethyl-λ5-phosphane (PubChem CID 140527909) has the molecular formula C9H22BrP and a molecular weight of 241.15 g/mol. Its IUPAC name is bromo-hexyl-trimethyl-λ5-phosphane.

Molecular Properties

Compound Namebromo-hexyl-trimethyl-λ5-phosphane
PubChem CID140527909
Molecular FormulaC9H22BrP
Molecular Weight241.15 g/mol
Exact Mass240.06
IUPAC Namebromo-hexyl-trimethyl-λ5-phosphane
SMILESCCCCCCP(C)(C)(C)Br
InChIInChI=1S/C9H22BrP/c1-5-6-7-8-9-11(2,3,4)10/h5-9H2,1-4H3
InChIKeyVMYLEJAFMKTLQQ-UHFFFAOYSA-N
XLogP4.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.15
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

bromo-trimethyl-tricosyl-λ5-phosphane
CID 140680177
bromo-methyl-trioctyl-lambda5-phosphane
CID 14009537
bromo-tetra(tetradecyl)-λ5-phosphane
CID 140527953
bromo-hexyl-trioctyl-λ5-phosphane
CID 140528145
bromo-triheptyl-pentyl-λ5-phosphane
CID 140527924
bromo-tetra(undecyl)-λ5-phosphane
CID 162511876
bromo-didodecyl-dipentyl-λ5-phosphane
CID 140527917
bromo-octadecyl-tripentyl-λ5-phosphane
CID 140527939
bromo(tetrahexadecyl)-lambda5-phosphane
CID 14009065
bromo-triheptyl-hexyl-λ5-phosphane
CID 140528130
bromo-ethyl-dimethyl-tetradecyl-λ5-phosphane
CID 139700828
bromo-dibutyl-dipentyl-λ5-phosphane
CID 140528033

Frequently Asked Questions

What is the IUPAC name of bromo-hexyl-trimethyl-λ5-phosphane?
The IUPAC name of bromo-hexyl-trimethyl-λ5-phosphane (CID 140527909) is bromo-hexyl-trimethyl-λ5-phosphane.
What is the SMILES notation for bromo-hexyl-trimethyl-λ5-phosphane?
The canonical SMILES for bromo-hexyl-trimethyl-λ5-phosphane is CCCCCCP(C)(C)(C)Br.
What is the InChIKey of bromo-hexyl-trimethyl-λ5-phosphane?
The InChIKey is VMYLEJAFMKTLQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22BrP/c1-5-6-7-8-9-11(2,3,4)10/h5-9H2,1-4H3.
What are the key properties of bromo-hexyl-trimethyl-λ5-phosphane?
bromo-hexyl-trimethyl-λ5-phosphane has a molecular weight of 241.15 g/mol, XLogP of 4.32, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo-hexyl-trimethyl-λ5-phosphane is sourced from PubChem (CID 140527909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).