2-(2-bromophenyl)-2-methoxyoxolane

C11H13BrO2 — CID 130366116

IUPAC2-(2-bromophenyl)-2-methoxyoxolane
SMILESCOC1(c2ccccc2Br)CCCO1
InChIInChI=1S/C11H13BrO2/c1-13-11(7-4-8-14-11)9-5-2-3-6-10(9)12/h2-3,5-6H,4,7-8H2,1H3
InChIKeyYCOXMWIPLQYDKU-UHFFFAOYSA-N
MW257.13 g/mol
LogP3.06
Rot. Bonds2

About 2-(2-bromophenyl)-2-methoxyoxolane

2-(2-bromophenyl)-2-methoxyoxolane (PubChem CID 130366116) has the molecular formula C11H13BrO2 and a molecular weight of 257.13 g/mol. Its IUPAC name is 2-(2-bromophenyl)-2-methoxyoxolane.

Molecular Properties

Compound Name2-(2-bromophenyl)-2-methoxyoxolane
PubChem CID130366116
Molecular FormulaC11H13BrO2
Molecular Weight257.13 g/mol
Exact Mass256.01
IUPAC Name2-(2-bromophenyl)-2-methoxyoxolane
SMILESCOC1(c2ccccc2Br)CCCO1
InChIInChI=1S/C11H13BrO2/c1-13-11(7-4-8-14-11)9-5-2-3-6-10(9)12/h2-3,5-6H,4,7-8H2,1H3
InChIKeyYCOXMWIPLQYDKU-UHFFFAOYSA-N
XLogP3.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.13
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methoxyoxolan-2-yl)furan
CID 141004568
2-(2-bromophenyl)-2-methyl-1,3-dioxolane
CID 615284
1-bromo-2-(1-methylcyclohexyl)benzene
CID 131090981
3-(2-bromophenyl)-3-methyloxolane
CID 115044033
1-(2-bromophenyl)cycloheptan-1-amine
CID 62830904
1-(2-bromophenyl)-N,N-dimethylcyclopentan-1-amine
CID 115049925
4-(2-bromophenyl)-N-methyloxan-4-amine
CID 83693916
[1-(2-bromophenyl)cycloheptyl]methanamine
CID 62829513
1-(2-bromophenyl)cyclopentan-1-amine;hydrochloride
CID 171935306
1-(3-bromo-2-methoxyphenyl)cyclopropan-1-amine
CID 82622115
2-(2-bromophenyl)-2-methylpyrrolidine
CID 82621906
N-[[1-(2-bromophenyl)cyclohexyl]methyl]propan-2-amine
CID 63512430

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-2-methoxyoxolane?
The IUPAC name of 2-(2-bromophenyl)-2-methoxyoxolane (CID 130366116) is 2-(2-bromophenyl)-2-methoxyoxolane.
What is the SMILES notation for 2-(2-bromophenyl)-2-methoxyoxolane?
The canonical SMILES for 2-(2-bromophenyl)-2-methoxyoxolane is COC1(c2ccccc2Br)CCCO1.
What is the InChIKey of 2-(2-bromophenyl)-2-methoxyoxolane?
The InChIKey is YCOXMWIPLQYDKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13BrO2/c1-13-11(7-4-8-14-11)9-5-2-3-6-10(9)12/h2-3,5-6H,4,7-8H2,1H3.
What are the key properties of 2-(2-bromophenyl)-2-methoxyoxolane?
2-(2-bromophenyl)-2-methoxyoxolane has a molecular weight of 257.13 g/mol, XLogP of 3.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-2-methoxyoxolane is sourced from PubChem (CID 130366116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).