(2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran

C17H15BrO — CID 162413914

IUPAC(2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran
SMILESBrc1ccc([C@H]2CC(c3ccccc3)=CCO2)cc1
InChIInChI=1S/C17H15BrO/c18-16-8-6-14(7-9-16)17-12-15(10-11-19-17)13-4-2-1-3-5-13/h1-10,17H,11-12H2/t17-/m1/s1
InChIKeyNSKXTYUWLZOZBJ-QGZVFWFLSA-N
MW315.21 g/mol
LogP4.99
Rot. Bonds2

About (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran

(2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran (PubChem CID 162413914) has the molecular formula C17H15BrO and a molecular weight of 315.21 g/mol. Its IUPAC name is (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran.

Molecular Properties

Compound Name(2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran
PubChem CID162413914
Molecular FormulaC17H15BrO
Molecular Weight315.21 g/mol
Exact Mass314.03
IUPAC Name(2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran
SMILESBrc1ccc([C@H]2CC(c3ccccc3)=CCO2)cc1
InChIInChI=1S/C17H15BrO/c18-16-8-6-14(7-9-16)17-12-15(10-11-19-17)13-4-2-1-3-5-13/h1-10,17H,11-12H2/t17-/m1/s1
InChIKeyNSKXTYUWLZOZBJ-QGZVFWFLSA-N
XLogP4.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.21
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran?
The IUPAC name of (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran (CID 162413914) is (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran.
What is the SMILES notation for (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran?
The canonical SMILES for (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran is Brc1ccc([C@H]2CC(c3ccccc3)=CCO2)cc1.
What is the InChIKey of (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran?
The InChIKey is NSKXTYUWLZOZBJ-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H15BrO/c18-16-8-6-14(7-9-16)17-12-15(10-11-19-17)13-4-2-1-3-5-13/h1-10,17H,11-12H2/t17-/m1/s1.
What are the key properties of (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran?
(2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran has a molecular weight of 315.21 g/mol, XLogP of 4.99, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-bromophenyl)-4-phenyl-3,6-dihydro-2H-pyran is sourced from PubChem (CID 162413914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).