1-bromo-4-phenylbenzene;1,3-dioxolane

C15H15BrO2 — CID 175223614

IUPAC1-bromo-4-phenylbenzene;1,3-dioxolane
SMILESBrc1ccc(-c2ccccc2)cc1.C1COCO1
InChIInChI=1S/C12H9Br.C3H6O2/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10;1-2-5-3-4-1/h1-9H;1-3H2
InChIKeyPIOFAWLUWJXIHD-UHFFFAOYSA-N
MW307.19 g/mol
LogP4.11
Rot. Bonds1

About 1-bromo-4-phenylbenzene;1,3-dioxolane

1-bromo-4-phenylbenzene;1,3-dioxolane (PubChem CID 175223614) has the molecular formula C15H15BrO2 and a molecular weight of 307.19 g/mol. Its IUPAC name is 1-bromo-4-phenylbenzene;1,3-dioxolane.

Molecular Properties

Compound Name1-bromo-4-phenylbenzene;1,3-dioxolane
PubChem CID175223614
Molecular FormulaC15H15BrO2
Molecular Weight307.19 g/mol
Exact Mass306.03
IUPAC Name1-bromo-4-phenylbenzene;1,3-dioxolane
SMILESBrc1ccc(-c2ccccc2)cc1.C1COCO1
InChIInChI=1S/C12H9Br.C3H6O2/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10;1-2-5-3-4-1/h1-9H;1-3H2
InChIKeyPIOFAWLUWJXIHD-UHFFFAOYSA-N
XLogP4.11
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.19
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-bromophenyl)-3-[4-[4-[3-(4-bromophenyl)-5-(4-phenylphenyl)phenyl]phenyl]phenyl]-5-(4-phenylphenyl)benzene
CID 102428633
1-bromo-4-phenylbenzene;N-methylmethanamine
CID 66862098
1-bromo-4-(4-iodophenyl)benzene;1-bromo-4-phenylbenzene
CID 162245084
1-bromo-4-[4-[4-(4-bromophenyl)phenyl]phenyl]benzene
CID 59775505
1-[bis(4-bromophenyl)-(4-phenylphenyl)methyl]-4-bromobenzene
CID 176748708
bromobenzene;hydrofluoride
CID 158803829
tetrakis(1-bromo-4-(4-bromophenyl)benzene) disulfide
CID 173034951
bromobenzene;trihydrofluoride
CID 173004651
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
1,1'-biphenyl;hydrofluoride
CID 67516975
1-(4-bromophenyl)-3-phenyl-2-benzofuran
CID 59538643
N-(4-bromophenyl)-N,4-diphenylaniline;oxolane;[4-(N-(4-phenylphenyl)anilino)phenyl]boronic acid
CID 158399925

Frequently Asked Questions

What is the IUPAC name of 1-bromo-4-phenylbenzene;1,3-dioxolane?
The IUPAC name of 1-bromo-4-phenylbenzene;1,3-dioxolane (CID 175223614) is 1-bromo-4-phenylbenzene;1,3-dioxolane.
What is the SMILES notation for 1-bromo-4-phenylbenzene;1,3-dioxolane?
The canonical SMILES for 1-bromo-4-phenylbenzene;1,3-dioxolane is Brc1ccc(-c2ccccc2)cc1.C1COCO1.
What is the InChIKey of 1-bromo-4-phenylbenzene;1,3-dioxolane?
The InChIKey is PIOFAWLUWJXIHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Br.C3H6O2/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10;1-2-5-3-4-1/h1-9H;1-3H2.
What are the key properties of 1-bromo-4-phenylbenzene;1,3-dioxolane?
1-bromo-4-phenylbenzene;1,3-dioxolane has a molecular weight of 307.19 g/mol, XLogP of 4.11, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-bromo-4-phenylbenzene;1,3-dioxolane is sourced from PubChem (CID 175223614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).