(Z)-1-diethoxyphosphorylselanylhex-1-ene

C10H21O3PSe — CID 15425443

IUPAC(Z)-1-diethoxyphosphorylselanylhex-1-ene
SMILESCCCC/C=C\[Se]P(=O)(OCC)OCC
InChIInChI=1S/C10H21O3PSe/c1-4-7-8-9-10-15-14(11,12-5-2)13-6-3/h9-10H,4-8H2,1-3H3/b10-9-
InChIKeyLRVYSSDIOJGCEZ-KTKRTIGZSA-N
MW299.21 g/mol
LogP3.58
Rot. Bonds9

About (Z)-1-diethoxyphosphorylselanylhex-1-ene

(Z)-1-diethoxyphosphorylselanylhex-1-ene (PubChem CID 15425443) has the molecular formula C10H21O3PSe and a molecular weight of 299.21 g/mol. Its IUPAC name is (Z)-1-diethoxyphosphorylselanylhex-1-ene.

Molecular Properties

Compound Name(Z)-1-diethoxyphosphorylselanylhex-1-ene
PubChem CID15425443
Molecular FormulaC10H21O3PSe
Molecular Weight299.21 g/mol
Exact Mass300.04
IUPAC Name(Z)-1-diethoxyphosphorylselanylhex-1-ene
SMILESCCCC/C=C\[Se]P(=O)(OCC)OCC
InChIInChI=1S/C10H21O3PSe/c1-4-7-8-9-10-15-14(11,12-5-2)13-6-3/h9-10H,4-8H2,1-3H3/b10-9-
InChIKeyLRVYSSDIOJGCEZ-KTKRTIGZSA-N
XLogP3.58
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.21
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-diethoxyphosphorylselanylhex-1-ene?
The IUPAC name of (Z)-1-diethoxyphosphorylselanylhex-1-ene (CID 15425443) is (Z)-1-diethoxyphosphorylselanylhex-1-ene.
What is the SMILES notation for (Z)-1-diethoxyphosphorylselanylhex-1-ene?
The canonical SMILES for (Z)-1-diethoxyphosphorylselanylhex-1-ene is CCCC/C=C\[Se]P(=O)(OCC)OCC.
What is the InChIKey of (Z)-1-diethoxyphosphorylselanylhex-1-ene?
The InChIKey is LRVYSSDIOJGCEZ-KTKRTIGZSA-N. The full InChI is InChI=1S/C10H21O3PSe/c1-4-7-8-9-10-15-14(11,12-5-2)13-6-3/h9-10H,4-8H2,1-3H3/b10-9-.
What are the key properties of (Z)-1-diethoxyphosphorylselanylhex-1-ene?
(Z)-1-diethoxyphosphorylselanylhex-1-ene has a molecular weight of 299.21 g/mol, XLogP of 3.58, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-diethoxyphosphorylselanylhex-1-ene is sourced from PubChem (CID 15425443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).