2-diethoxyphosphorylethenylidenecyclopentane

C11H19O3P — CID 23280733

IUPAC2-diethoxyphosphorylethenylidenecyclopentane
SMILESCCOP(=O)(C=C=C1CCCC1)OCC
InChIInChI=1S/C11H19O3P/c1-3-13-15(12,14-4-2)10-9-11-7-5-6-8-11/h10H,3-8H2,1-2H3
InChIKeyPRZVZNGYWWIZTN-UHFFFAOYSA-N
MW230.24 g/mol
LogP3.87
Rot. Bonds5

About 2-diethoxyphosphorylethenylidenecyclopentane

2-diethoxyphosphorylethenylidenecyclopentane (PubChem CID 23280733) has the molecular formula C11H19O3P and a molecular weight of 230.24 g/mol. Its IUPAC name is 2-diethoxyphosphorylethenylidenecyclopentane.

Molecular Properties

Compound Name2-diethoxyphosphorylethenylidenecyclopentane
PubChem CID23280733
Molecular FormulaC11H19O3P
Molecular Weight230.24 g/mol
Exact Mass230.11
IUPAC Name2-diethoxyphosphorylethenylidenecyclopentane
SMILESCCOP(=O)(C=C=C1CCCC1)OCC
InChIInChI=1S/C11H19O3P/c1-3-13-15(12,14-4-2)10-9-11-7-5-6-8-11/h10H,3-8H2,1-2H3
InChIKeyPRZVZNGYWWIZTN-UHFFFAOYSA-N
XLogP3.87
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.24
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Diethyl (2-cyclohexylideneethenyl)phosphonate
CID 12473820
Diethoxyphosphorylmethylidenecyclohexane
CID 12860450
(2-Diethoxyphosphoryl-3,3,3-trifluoroprop-1-enylidene)cyclopentane
CID 102260719
(3Z)-3-(diethoxyphosphorylmethylidene)heptane
CID 10562512
(Z)-1-diethoxyphosphoryl-2-methylhex-1-ene
CID 10633435
5-(Diethoxyphosphorylmethylidene)nonane
CID 10660090
[Chloro(diethoxyphosphoryl)methylidene]cyclopentane
CID 10824734
(E)-1-diethoxyphosphoryl-2-methyloct-1-ene
CID 10849072
3-(Diethoxyphosphorylmethyl)hepta-1,2-diene
CID 12533983
5-Diethoxyphosphoryl-2-methylhexa-2,3-diene
CID 12534457
3-Diethoxyphosphorylhepta-1,2-diene
CID 16079428
4-Diethoxyphosphoryl-2-methylocta-2,3-diene
CID 25215108

Frequently Asked Questions

What is the IUPAC name of 2-diethoxyphosphorylethenylidenecyclopentane?
The IUPAC name of 2-diethoxyphosphorylethenylidenecyclopentane (CID 23280733) is 2-diethoxyphosphorylethenylidenecyclopentane.
What is the SMILES notation for 2-diethoxyphosphorylethenylidenecyclopentane?
The canonical SMILES for 2-diethoxyphosphorylethenylidenecyclopentane is CCOP(=O)(C=C=C1CCCC1)OCC.
What is the InChIKey of 2-diethoxyphosphorylethenylidenecyclopentane?
The InChIKey is PRZVZNGYWWIZTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19O3P/c1-3-13-15(12,14-4-2)10-9-11-7-5-6-8-11/h10H,3-8H2,1-2H3.
What are the key properties of 2-diethoxyphosphorylethenylidenecyclopentane?
2-diethoxyphosphorylethenylidenecyclopentane has a molecular weight of 230.24 g/mol, XLogP of 3.87, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diethoxyphosphorylethenylidenecyclopentane is sourced from PubChem (CID 23280733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).