2-(2-bromophenyl)-2-methyl-1,3-dioxolane

C10H11BrO2 — CID 615284

IUPAC2-(2-bromophenyl)-2-methyl-1,3-dioxolane
SMILESCC1(c2ccccc2Br)OCCO1
InChIInChI=1S/C10H11BrO2/c1-10(12-6-7-13-10)8-4-2-3-5-9(8)11/h2-5H,6-7H2,1H3
InChIKeyIMTMVLZKQOKWKK-UHFFFAOYSA-N
MW243.10 g/mol
LogP2.67
Rot. Bonds1

About 2-(2-bromophenyl)-2-methyl-1,3-dioxolane

2-(2-bromophenyl)-2-methyl-1,3-dioxolane (PubChem CID 615284) has the molecular formula C10H11BrO2 and a molecular weight of 243.10 g/mol. Its IUPAC name is 2-(2-bromophenyl)-2-methyl-1,3-dioxolane.

Molecular Properties

Compound Name2-(2-bromophenyl)-2-methyl-1,3-dioxolane
PubChem CID615284
Molecular FormulaC10H11BrO2
Molecular Weight243.10 g/mol
Exact Mass241.99
IUPAC Name2-(2-bromophenyl)-2-methyl-1,3-dioxolane
SMILESCC1(c2ccccc2Br)OCCO1
InChIInChI=1S/C10H11BrO2/c1-10(12-6-7-13-10)8-4-2-3-5-9(8)11/h2-5H,6-7H2,1H3
InChIKeyIMTMVLZKQOKWKK-UHFFFAOYSA-N
XLogP2.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.10
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-2-methyl-1,3-dioxolane?
The IUPAC name of 2-(2-bromophenyl)-2-methyl-1,3-dioxolane (CID 615284) is 2-(2-bromophenyl)-2-methyl-1,3-dioxolane.
What is the SMILES notation for 2-(2-bromophenyl)-2-methyl-1,3-dioxolane?
The canonical SMILES for 2-(2-bromophenyl)-2-methyl-1,3-dioxolane is CC1(c2ccccc2Br)OCCO1.
What is the InChIKey of 2-(2-bromophenyl)-2-methyl-1,3-dioxolane?
The InChIKey is IMTMVLZKQOKWKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrO2/c1-10(12-6-7-13-10)8-4-2-3-5-9(8)11/h2-5H,6-7H2,1H3.
What are the key properties of 2-(2-bromophenyl)-2-methyl-1,3-dioxolane?
2-(2-bromophenyl)-2-methyl-1,3-dioxolane has a molecular weight of 243.10 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-2-methyl-1,3-dioxolane is sourced from PubChem (CID 615284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).