2-ethenoxy-2-methylpropane;phenylphosphane

C12H19OP — CID 68556774

IUPAC2-ethenoxy-2-methylpropane;phenylphosphane
SMILESC=COC(C)(C)C.Pc1ccccc1
InChIInChI=1S/C6H12O.C6H7P/c1-5-7-6(2,3)4;7-6-4-2-1-3-5-6/h5H,1H2,2-4H3;1-5H,7H2
InChIKeyHBPUATAEQUKEOO-UHFFFAOYSA-N
MW210.26 g/mol
LogP3.13
Rot. Bonds1

About 2-ethenoxy-2-methylpropane;phenylphosphane

2-ethenoxy-2-methylpropane;phenylphosphane (PubChem CID 68556774) has the molecular formula C12H19OP and a molecular weight of 210.26 g/mol. Its IUPAC name is 2-ethenoxy-2-methylpropane;phenylphosphane.

Molecular Properties

Compound Name2-ethenoxy-2-methylpropane;phenylphosphane
PubChem CID68556774
Molecular FormulaC12H19OP
Molecular Weight210.26 g/mol
Exact Mass210.12
IUPAC Name2-ethenoxy-2-methylpropane;phenylphosphane
SMILESC=COC(C)(C)C.Pc1ccccc1
InChIInChI=1S/C6H12O.C6H7P/c1-5-7-6(2,3)4;7-6-4-2-1-3-5-6/h5H,1H2,2-4H3;1-5H,7H2
InChIKeyHBPUATAEQUKEOO-UHFFFAOYSA-N
XLogP3.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

1,4-bis(1-ethenoxy-1-phenylethyl)benzene
CID 22935837
ethane;phenylphosphane;phosphane
CID 160653411
phenylphosphane;hydrochloride
CID 172838104
palladium(2+);phenylphosphane
CID 18006167
nickel;phenylphosphane;hydrochloride
CID 88505653
(3,4-dimethyl-4-phenylhexa-1,5-dien-3-yl)benzene
CID 166095951
anisole;phenylphosphane
CID 142274985
dichloropalladium;phenylphosphane
CID 87787995
dichlororuthenium;phenylphosphane
CID 88728124
chloro thiohypochlorite;phenylphosphane
CID 170851683
1-chloro-1,1-bis(ethenoxy)ethane
CID 24973192
carbonic acid;phenylphosphane
CID 173309106

Frequently Asked Questions

What is the IUPAC name of 2-ethenoxy-2-methylpropane;phenylphosphane?
The IUPAC name of 2-ethenoxy-2-methylpropane;phenylphosphane (CID 68556774) is 2-ethenoxy-2-methylpropane;phenylphosphane.
What is the SMILES notation for 2-ethenoxy-2-methylpropane;phenylphosphane?
The canonical SMILES for 2-ethenoxy-2-methylpropane;phenylphosphane is C=COC(C)(C)C.Pc1ccccc1.
What is the InChIKey of 2-ethenoxy-2-methylpropane;phenylphosphane?
The InChIKey is HBPUATAEQUKEOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O.C6H7P/c1-5-7-6(2,3)4;7-6-4-2-1-3-5-6/h5H,1H2,2-4H3;1-5H,7H2.
What are the key properties of 2-ethenoxy-2-methylpropane;phenylphosphane?
2-ethenoxy-2-methylpropane;phenylphosphane has a molecular weight of 210.26 g/mol, XLogP of 3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenoxy-2-methylpropane;phenylphosphane is sourced from PubChem (CID 68556774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).