phenyl-bis(2-prop-2-enoxyethoxy)phosphane

C16H23O4P — CID 69339497

IUPACphenyl-bis(2-prop-2-enoxyethoxy)phosphane
SMILESC=CCOCCOP(OCCOCC=C)c1ccccc1
InChIInChI=1S/C16H23O4P/c1-3-10-17-12-14-19-21(16-8-6-5-7-9-16)20-15-13-18-11-4-2/h3-9H,1-2,10-15H2
InChIKeyWSIDBZHSCWPAAW-UHFFFAOYSA-N
MW310.33 g/mol
LogP3.06
Rot. Bonds13

About phenyl-bis(2-prop-2-enoxyethoxy)phosphane

phenyl-bis(2-prop-2-enoxyethoxy)phosphane (PubChem CID 69339497) has the molecular formula C16H23O4P and a molecular weight of 310.33 g/mol. Its IUPAC name is phenyl-bis(2-prop-2-enoxyethoxy)phosphane.

Molecular Properties

Compound Namephenyl-bis(2-prop-2-enoxyethoxy)phosphane
PubChem CID69339497
Molecular FormulaC16H23O4P
Molecular Weight310.33 g/mol
Exact Mass310.13
IUPAC Namephenyl-bis(2-prop-2-enoxyethoxy)phosphane
SMILESC=CCOCCOP(OCCOCC=C)c1ccccc1
InChIInChI=1S/C16H23O4P/c1-3-10-17-12-14-19-21(16-8-6-5-7-9-16)20-15-13-18-11-4-2/h3-9H,1-2,10-15H2
InChIKeyWSIDBZHSCWPAAW-UHFFFAOYSA-N
XLogP3.06
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.33
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phenyl-bis(2-prop-2-enoxyethoxy)phosphane?
The IUPAC name of phenyl-bis(2-prop-2-enoxyethoxy)phosphane (CID 69339497) is phenyl-bis(2-prop-2-enoxyethoxy)phosphane.
What is the SMILES notation for phenyl-bis(2-prop-2-enoxyethoxy)phosphane?
The canonical SMILES for phenyl-bis(2-prop-2-enoxyethoxy)phosphane is C=CCOCCOP(OCCOCC=C)c1ccccc1.
What is the InChIKey of phenyl-bis(2-prop-2-enoxyethoxy)phosphane?
The InChIKey is WSIDBZHSCWPAAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23O4P/c1-3-10-17-12-14-19-21(16-8-6-5-7-9-16)20-15-13-18-11-4-2/h3-9H,1-2,10-15H2.
What are the key properties of phenyl-bis(2-prop-2-enoxyethoxy)phosphane?
phenyl-bis(2-prop-2-enoxyethoxy)phosphane has a molecular weight of 310.33 g/mol, XLogP of 3.06, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-bis(2-prop-2-enoxyethoxy)phosphane is sourced from PubChem (CID 69339497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).