(4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide

C10H15O4P — CID 11379209

IUPAC(4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide
SMILESC=CCOP1(=O)O[C@H](C=C)C[C@@H](C=C)O1
InChIInChI=1S/C10H15O4P/c1-4-7-12-15(11)13-9(5-2)8-10(6-3)14-15/h4-6,9-10H,1-3,7-8H2/t9-,10-/m1/s1
InChIKeyFODUWWVVJOKQRJ-NXEZZACHSA-N
MW230.20 g/mol
LogP2.84
Rot. Bonds5

About (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide

(4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide (PubChem CID 11379209) has the molecular formula C10H15O4P and a molecular weight of 230.20 g/mol. Its IUPAC name is (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide.

Molecular Properties

Compound Name(4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide
PubChem CID11379209
Molecular FormulaC10H15O4P
Molecular Weight230.20 g/mol
Exact Mass230.07
IUPAC Name(4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide
SMILESC=CCOP1(=O)O[C@H](C=C)C[C@@H](C=C)O1
InChIInChI=1S/C10H15O4P/c1-4-7-12-15(11)13-9(5-2)8-10(6-3)14-15/h4-6,9-10H,1-3,7-8H2/t9-,10-/m1/s1
InChIKeyFODUWWVVJOKQRJ-NXEZZACHSA-N
XLogP2.84
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.20
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'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 (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide?
The IUPAC name of (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide (CID 11379209) is (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide.
What is the SMILES notation for (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide?
The canonical SMILES for (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide is C=CCOP1(=O)O[C@H](C=C)C[C@@H](C=C)O1.
What is the InChIKey of (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide?
The InChIKey is FODUWWVVJOKQRJ-NXEZZACHSA-N. The full InChI is InChI=1S/C10H15O4P/c1-4-7-12-15(11)13-9(5-2)8-10(6-3)14-15/h4-6,9-10H,1-3,7-8H2/t9-,10-/m1/s1.
What are the key properties of (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide?
(4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide has a molecular weight of 230.20 g/mol, XLogP of 2.84, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S,6S)-4,6-bis(ethenyl)-2-prop-2-enoxy-1,3,2λ5-dioxaphosphinane 2-oxide is sourced from PubChem (CID 11379209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).