[3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane

C10H13O2P — CID 88999598

IUPAC[3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane
SMILESCC1(c2cccc(P)c2)OCCO1
InChIInChI=1S/C10H13O2P/c1-10(11-5-6-12-10)8-3-2-4-9(13)7-8/h2-4,7H,5-6,13H2,1H3
InChIKeyAFVLDVGNIZRPSJ-UHFFFAOYSA-N
MW196.19 g/mol
LogP1.41
Rot. Bonds1

About [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane

[3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane (PubChem CID 88999598) has the molecular formula C10H13O2P and a molecular weight of 196.19 g/mol. Its IUPAC name is [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane.

Molecular Properties

Compound Name[3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane
PubChem CID88999598
Molecular FormulaC10H13O2P
Molecular Weight196.19 g/mol
Exact Mass196.07
IUPAC Name[3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane
SMILESCC1(c2cccc(P)c2)OCCO1
InChIInChI=1S/C10H13O2P/c1-10(11-5-6-12-10)8-3-2-4-9(13)7-8/h2-4,7H,5-6,13H2,1H3
InChIKeyAFVLDVGNIZRPSJ-UHFFFAOYSA-N
XLogP1.41
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.19
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane?
The IUPAC name of [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane (CID 88999598) is [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane.
What is the SMILES notation for [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane?
The canonical SMILES for [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is CC1(c2cccc(P)c2)OCCO1.
What is the InChIKey of [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane?
The InChIKey is AFVLDVGNIZRPSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13O2P/c1-10(11-5-6-12-10)8-3-2-4-9(13)7-8/h2-4,7H,5-6,13H2,1H3.
What are the key properties of [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane?
[3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane has a molecular weight of 196.19 g/mol, XLogP of 1.41, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methyl-1,3-dioxolan-2-yl)phenyl]phosphane is sourced from PubChem (CID 88999598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).