heptadecan-2-ylphosphane

C17H37P — CID 154117788

IUPACheptadecan-2-ylphosphane
SMILESCCCCCCCCCCCCCCCC(C)P
InChIInChI=1S/C17H37P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)18/h17H,3-16,18H2,1-2H3
InChIKeyRZGMAYULAPGFNK-UHFFFAOYSA-N
MW272.46 g/mol
LogP6.73
Rot. Bonds14

About heptadecan-2-ylphosphane

heptadecan-2-ylphosphane (PubChem CID 154117788) has the molecular formula C17H37P and a molecular weight of 272.46 g/mol. Its IUPAC name is heptadecan-2-ylphosphane.

Molecular Properties

Compound Nameheptadecan-2-ylphosphane
PubChem CID154117788
Molecular FormulaC17H37P
Molecular Weight272.46 g/mol
Exact Mass272.26
IUPAC Nameheptadecan-2-ylphosphane
SMILESCCCCCCCCCCCCCCCC(C)P
InChIInChI=1S/C17H37P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)18/h17H,3-16,18H2,1-2H3
InChIKeyRZGMAYULAPGFNK-UHFFFAOYSA-N
XLogP6.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.46
LogP ≤ 56.73
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

pentadecan-2-ylphosphane
CID 154118597
decan-2-ylphosphane;thulium
CID 87745416
dodecan-6-ylphosphane
CID 88935198
heptatriacontan-19-ylphosphane
CID 18405829
1-phosphanylundecylphosphane
CID 23414194
nonadecan-10-ylphosphane
CID 175556620
11-methylhentriacontane
CID 520767
(9R)-9-methylhenicosane
CID 170848396
6-methyltetradecane
CID 529900
(7R)-7-methyltricosane
CID 162971691
15-methylhexatriacontane
CID 86002594
2-methyldecane
CID 23415

Frequently Asked Questions

What is the IUPAC name of heptadecan-2-ylphosphane?
The IUPAC name of heptadecan-2-ylphosphane (CID 154117788) is heptadecan-2-ylphosphane.
What is the SMILES notation for heptadecan-2-ylphosphane?
The canonical SMILES for heptadecan-2-ylphosphane is CCCCCCCCCCCCCCCC(C)P.
What is the InChIKey of heptadecan-2-ylphosphane?
The InChIKey is RZGMAYULAPGFNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)18/h17H,3-16,18H2,1-2H3.
What are the key properties of heptadecan-2-ylphosphane?
heptadecan-2-ylphosphane has a molecular weight of 272.46 g/mol, XLogP of 6.73, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for heptadecan-2-ylphosphane is sourced from PubChem (CID 154117788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).