dodecyl-fluoro-tripropyl-λ5-phosphane

C21H46FP — CID 141204529

IUPACdodecyl-fluoro-tripropyl-λ5-phosphane
SMILESCCCCCCCCCCCCP(F)(CCC)(CCC)CCC
InChIInChI=1S/C21H46FP/c1-5-9-10-11-12-13-14-15-16-17-21-23(22,18-6-2,19-7-3)20-8-4/h5-21H2,1-4H3
InChIKeyJDQIYBMBTJWNJI-UHFFFAOYSA-N
MW348.57 g/mol
LogP8.58
Rot. Bonds17

About dodecyl-fluoro-tripropyl-λ5-phosphane

dodecyl-fluoro-tripropyl-λ5-phosphane (PubChem CID 141204529) has the molecular formula C21H46FP and a molecular weight of 348.57 g/mol. Its IUPAC name is dodecyl-fluoro-tripropyl-λ5-phosphane.

Molecular Properties

Compound Namedodecyl-fluoro-tripropyl-λ5-phosphane
PubChem CID141204529
Molecular FormulaC21H46FP
Molecular Weight348.57 g/mol
Exact Mass348.33
IUPAC Namedodecyl-fluoro-tripropyl-λ5-phosphane
SMILESCCCCCCCCCCCCP(F)(CCC)(CCC)CCC
InChIInChI=1S/C21H46FP/c1-5-9-10-11-12-13-14-15-16-17-21-23(22,18-6-2,19-7-3)20-8-4/h5-21H2,1-4H3
InChIKeyJDQIYBMBTJWNJI-UHFFFAOYSA-N
XLogP8.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds17
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.57
LogP ≤ 58.58
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

tetrabutyl(fluoro)-lambda5-phosphane;dihydrofluoride
CID 14950742
iodo-trioctyl-propyl-λ5-phosphane
CID 140528088
heptyl-iodo-tripropyl-λ5-phosphane
CID 140527815
(1,2,3,4,5,6,7,8,9,10,11,12-13C12)dodecane
CID 71309250
dodecane;pentadecane
CID 162065772
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
decane;heptane
CID 159049036
dohexacontane
CID 522644
CID 161246447
CID 161246447

Frequently Asked Questions

What is the IUPAC name of dodecyl-fluoro-tripropyl-λ5-phosphane?
The IUPAC name of dodecyl-fluoro-tripropyl-λ5-phosphane (CID 141204529) is dodecyl-fluoro-tripropyl-λ5-phosphane.
What is the SMILES notation for dodecyl-fluoro-tripropyl-λ5-phosphane?
The canonical SMILES for dodecyl-fluoro-tripropyl-λ5-phosphane is CCCCCCCCCCCCP(F)(CCC)(CCC)CCC.
What is the InChIKey of dodecyl-fluoro-tripropyl-λ5-phosphane?
The InChIKey is JDQIYBMBTJWNJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46FP/c1-5-9-10-11-12-13-14-15-16-17-21-23(22,18-6-2,19-7-3)20-8-4/h5-21H2,1-4H3.
What are the key properties of dodecyl-fluoro-tripropyl-λ5-phosphane?
dodecyl-fluoro-tripropyl-λ5-phosphane has a molecular weight of 348.57 g/mol, XLogP of 8.58, 17 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dodecyl-fluoro-tripropyl-λ5-phosphane is sourced from PubChem (CID 141204529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).