methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane

C11H25O2P — CID 167648199

IUPACmethylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane
SMILESC=P(CC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C11H25O2P/c1-9(2)8-14(7,12-10(3)4)13-11(5)6/h9-11H,7-8H2,1-6H3
InChIKeyWHDRFUOPFQIFFB-UHFFFAOYSA-N
MW220.29 g/mol
LogP3.77
Rot. Bonds6

About methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane

methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane (PubChem CID 167648199) has the molecular formula C11H25O2P and a molecular weight of 220.29 g/mol. Its IUPAC name is methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane.

Molecular Properties

Compound Namemethylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane
PubChem CID167648199
Molecular FormulaC11H25O2P
Molecular Weight220.29 g/mol
Exact Mass220.16
IUPAC Namemethylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane
SMILESC=P(CC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C11H25O2P/c1-9(2)8-14(7,12-10(3)4)13-11(5)6/h9-11H,7-8H2,1-6H3
InChIKeyWHDRFUOPFQIFFB-UHFFFAOYSA-N
XLogP3.77
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

hydroxy-methyl-methylidene-(2-methylpropyl)-λ5-phosphane
CID 58584280
1-[di(propan-2-yloxy)phosphorylmethyl-propan-2-yloxyphosphoryl]-2-methylpropane
CID 14248164
2-methyl-1-[2-methylpropyl(propan-2-yloxy)phosphoryl]oxypropane
CID 175524065
2-methyl-2-[methyl(propan-2-yloxy)phosphoryl]oxypropane
CID 171057571
2-dimethylphosphoryloxypropane
CID 12572720
2-[dimethylphosphoryloxy(methyl)phosphoryl]oxypropane
CID 158432359
1-di(propan-2-yloxy)phosphoryl-3-methylbutan-1-one
CID 125475807
tris[[methyl(2-methylpropyl)phosphoryl]oxy]alumane
CID 176884398
iodomethyl dipropan-2-yl phosphate
CID 150487701
2-methylpropyl dipropan-2-yl phosphate
CID 10728615
methane;methylidene-tris(2-methylpropoxy)-λ5-phosphane
CID 158113780
CID 175885039
CID 175885039

Frequently Asked Questions

What is the IUPAC name of methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane?
The IUPAC name of methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane (CID 167648199) is methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane.
What is the SMILES notation for methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane?
The canonical SMILES for methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane is C=P(CC(C)C)(OC(C)C)OC(C)C.
What is the InChIKey of methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane?
The InChIKey is WHDRFUOPFQIFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25O2P/c1-9(2)8-14(7,12-10(3)4)13-11(5)6/h9-11H,7-8H2,1-6H3.
What are the key properties of methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane?
methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane has a molecular weight of 220.29 g/mol, XLogP of 3.77, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methylidene-(2-methylpropyl)-di(propan-2-yloxy)-λ5-phosphane is sourced from PubChem (CID 167648199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).