[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane

C18H21O2P — CID 10870301

IUPAC[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane
SMILESCC1(C)OC[C@H](CP(c2ccccc2)c2ccccc2)O1
InChIInChI=1S/C18H21O2P/c1-18(2)19-13-15(20-18)14-21(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3/t15-/m1/s1
InChIKeyQSOXCKKGEXQONP-OAHLLOKOSA-N
MW300.34 g/mol
LogP3.27
Rot. Bonds4

About [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane

[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane (PubChem CID 10870301) has the molecular formula C18H21O2P and a molecular weight of 300.34 g/mol. Its IUPAC name is [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane.

Molecular Properties

Compound Name[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane
PubChem CID10870301
Molecular FormulaC18H21O2P
Molecular Weight300.34 g/mol
Exact Mass300.13
IUPAC Name[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane
SMILESCC1(C)OC[C@H](CP(c2ccccc2)c2ccccc2)O1
InChIInChI=1S/C18H21O2P/c1-18(2)19-13-15(20-18)14-21(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3/t15-/m1/s1
InChIKeyQSOXCKKGEXQONP-OAHLLOKOSA-N
XLogP3.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.34
LogP ≤ 53.27
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 [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane?
The IUPAC name of [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane (CID 10870301) is [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane.
What is the SMILES notation for [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane?
The canonical SMILES for [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane is CC1(C)OC[C@H](CP(c2ccccc2)c2ccccc2)O1.
What is the InChIKey of [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane?
The InChIKey is QSOXCKKGEXQONP-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H21O2P/c1-18(2)19-13-15(20-18)14-21(16-9-5-3-6-10-16)17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3/t15-/m1/s1.
What are the key properties of [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane?
[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane has a molecular weight of 300.34 g/mol, XLogP of 3.27, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methyl-diphenylphosphane is sourced from PubChem (CID 10870301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).