5-propylnonan-5-yloxyphosphane

C12H27OP — CID 23352969

IUPAC5-propylnonan-5-yloxyphosphane
SMILESCCCCC(CCC)(CCCC)OP
InChIInChI=1S/C12H27OP/c1-4-7-10-12(13-14,9-6-3)11-8-5-2/h4-11,14H2,1-3H3
InChIKeyUYJROEBZELXDDT-UHFFFAOYSA-N
MW218.32 g/mol
LogP4.71
Rot. Bonds9

About 5-propylnonan-5-yloxyphosphane

5-propylnonan-5-yloxyphosphane (PubChem CID 23352969) has the molecular formula C12H27OP and a molecular weight of 218.32 g/mol. Its IUPAC name is 5-propylnonan-5-yloxyphosphane.

Molecular Properties

Compound Name5-propylnonan-5-yloxyphosphane
PubChem CID23352969
Molecular FormulaC12H27OP
Molecular Weight218.32 g/mol
Exact Mass218.18
IUPAC Name5-propylnonan-5-yloxyphosphane
SMILESCCCCC(CCC)(CCCC)OP
InChIInChI=1S/C12H27OP/c1-4-7-10-12(13-14,9-6-3)11-8-5-2/h4-11,14H2,1-3H3
InChIKeyUYJROEBZELXDDT-UHFFFAOYSA-N
XLogP4.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

10-methoxy-10-propylicosane
CID 158279749
10-methoxy-10-propyltricosane
CID 159618690
5-butyl-5-(5-butylnonan-5-yloxy)nonane
CID 57230356
oxo-bis(5-propylnonan-5-yloxy)phosphanium
CID 87060248
11-propyl-11-(11-propylhenicosan-11-ylperoxy)henicosane
CID 155668142
tris(3-ethylheptan-3-yloxy)alumane
CID 141438993
3-methoxy-3-propyloctan-1-ol
CID 142753036
5-methoxy-5-(3-methoxypropyl)nonane
CID 141413448
11-methoxy-11-nonyltetracosane
CID 159441841
5-propyldecan-5-yl acetate
CID 172855546
dibutyl 5-propylnonan-5-yl phosphate
CID 174698819
5-butylnonan-5-yl methyl carbonate
CID 141441033

Frequently Asked Questions

What is the IUPAC name of 5-propylnonan-5-yloxyphosphane?
The IUPAC name of 5-propylnonan-5-yloxyphosphane (CID 23352969) is 5-propylnonan-5-yloxyphosphane.
What is the SMILES notation for 5-propylnonan-5-yloxyphosphane?
The canonical SMILES for 5-propylnonan-5-yloxyphosphane is CCCCC(CCC)(CCCC)OP.
What is the InChIKey of 5-propylnonan-5-yloxyphosphane?
The InChIKey is UYJROEBZELXDDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27OP/c1-4-7-10-12(13-14,9-6-3)11-8-5-2/h4-11,14H2,1-3H3.
What are the key properties of 5-propylnonan-5-yloxyphosphane?
5-propylnonan-5-yloxyphosphane has a molecular weight of 218.32 g/mol, XLogP of 4.71, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propylnonan-5-yloxyphosphane is sourced from PubChem (CID 23352969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).