iodo-trimethyl-nonyl-λ5-phosphane

C12H28IP — CID 140527821

IUPACiodo-trimethyl-nonyl-λ5-phosphane
SMILESCCCCCCCCCP(C)(C)(C)I
InChIInChI=1S/C12H28IP/c1-5-6-7-8-9-10-11-12-14(2,3,4)13/h5-12H2,1-4H3
InChIKeyRAFMUILXDHIVTD-UHFFFAOYSA-N
MW330.23 g/mol
LogP5.53
Rot. Bonds8

About iodo-trimethyl-nonyl-λ5-phosphane

iodo-trimethyl-nonyl-λ5-phosphane (PubChem CID 140527821) has the molecular formula C12H28IP and a molecular weight of 330.23 g/mol. Its IUPAC name is iodo-trimethyl-nonyl-λ5-phosphane.

Molecular Properties

Compound Nameiodo-trimethyl-nonyl-λ5-phosphane
PubChem CID140527821
Molecular FormulaC12H28IP
Molecular Weight330.23 g/mol
Exact Mass330.10
IUPAC Nameiodo-trimethyl-nonyl-λ5-phosphane
SMILESCCCCCCCCCP(C)(C)(C)I
InChIInChI=1S/C12H28IP/c1-5-6-7-8-9-10-11-12-14(2,3,4)13/h5-12H2,1-4H3
InChIKeyRAFMUILXDHIVTD-UHFFFAOYSA-N
XLogP5.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.23
LogP ≤ 55.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

triheptyl-iodo-methyl-λ5-phosphane
CID 140527858
iodo-dipentyl-di(tetradecyl)-λ5-phosphane
CID 140527954
triheptyl-iodo-octyl-λ5-phosphane
CID 140527558
iodo-trioctyl-propyl-λ5-phosphane
CID 140528088
heptyl-iodo-tripropyl-λ5-phosphane
CID 140527815
didodecyl-diethyl-iodo-λ5-phosphane
CID 140528028
triethyl-iodo-nonyl-λ5-phosphane
CID 140527728
triethyl-hexyl-iodo-λ5-phosphane
CID 140527694
chloro-ethyl-dimethyl-tetradecyl-λ5-phosphane
CID 139700838
bromo-trimethyl-tricosyl-λ5-phosphane
CID 140680177
diethyl-iodo-dipentyl-λ5-phosphane
CID 140527925
chloro-trimethyl-tetracosyl-λ5-phosphane
CID 140680178

Frequently Asked Questions

What is the IUPAC name of iodo-trimethyl-nonyl-λ5-phosphane?
The IUPAC name of iodo-trimethyl-nonyl-λ5-phosphane (CID 140527821) is iodo-trimethyl-nonyl-λ5-phosphane.
What is the SMILES notation for iodo-trimethyl-nonyl-λ5-phosphane?
The canonical SMILES for iodo-trimethyl-nonyl-λ5-phosphane is CCCCCCCCCP(C)(C)(C)I.
What is the InChIKey of iodo-trimethyl-nonyl-λ5-phosphane?
The InChIKey is RAFMUILXDHIVTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28IP/c1-5-6-7-8-9-10-11-12-14(2,3,4)13/h5-12H2,1-4H3.
What are the key properties of iodo-trimethyl-nonyl-λ5-phosphane?
iodo-trimethyl-nonyl-λ5-phosphane has a molecular weight of 330.23 g/mol, XLogP of 5.53, 8 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iodo-trimethyl-nonyl-λ5-phosphane is sourced from PubChem (CID 140527821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).