2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane

C19H15BrO2 — CID 23016039

IUPAC2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane
SMILESBrc1c(C2(c3ccccc3)OCCO2)ccc2ccccc12
InChIInChI=1S/C19H15BrO2/c20-18-16-9-5-4-6-14(16)10-11-17(18)19(21-12-13-22-19)15-7-2-1-3-8-15/h1-11H,12-13H2
InChIKeyOEDJPRQHMQWGJJ-UHFFFAOYSA-N
MW355.23 g/mol
LogP4.85
Rot. Bonds2

About 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane

2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane (PubChem CID 23016039) has the molecular formula C19H15BrO2 and a molecular weight of 355.23 g/mol. Its IUPAC name is 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane.

Molecular Properties

Compound Name2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane
PubChem CID23016039
Molecular FormulaC19H15BrO2
Molecular Weight355.23 g/mol
Exact Mass354.03
IUPAC Name2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane
SMILESBrc1c(C2(c3ccccc3)OCCO2)ccc2ccccc12
InChIInChI=1S/C19H15BrO2/c20-18-16-9-5-4-6-14(16)10-11-17(18)19(21-12-13-22-19)15-7-2-1-3-8-15/h1-11H,12-13H2
InChIKeyOEDJPRQHMQWGJJ-UHFFFAOYSA-N
XLogP4.85
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.23
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane?
The IUPAC name of 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane (CID 23016039) is 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane.
What is the SMILES notation for 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane?
The canonical SMILES for 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane is Brc1c(C2(c3ccccc3)OCCO2)ccc2ccccc12.
What is the InChIKey of 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane?
The InChIKey is OEDJPRQHMQWGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15BrO2/c20-18-16-9-5-4-6-14(16)10-11-17(18)19(21-12-13-22-19)15-7-2-1-3-8-15/h1-11H,12-13H2.
What are the key properties of 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane?
2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane has a molecular weight of 355.23 g/mol, XLogP of 4.85, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-bromonaphthalen-2-yl)-2-phenyl-1,3-dioxolane is sourced from PubChem (CID 23016039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).