(2S,4R)-2,4-diphenyloxolane

C16H16O — CID 10775525

IUPAC(2S,4R)-2,4-diphenyloxolane
SMILESc1ccc([C@@H]2CO[C@H](c3ccccc3)C2)cc1
InChIInChI=1S/C16H16O/c1-3-7-13(8-4-1)15-11-16(17-12-15)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2/t15-,16-/m0/s1
InChIKeyDTRWVAWUKAYYNM-HOTGVXAUSA-N
MW224.30 g/mol
LogP3.93
Rot. Bonds2

About (2S,4R)-2,4-diphenyloxolane

(2S,4R)-2,4-diphenyloxolane (PubChem CID 10775525) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is (2S,4R)-2,4-diphenyloxolane.

Molecular Properties

Compound Name(2S,4R)-2,4-diphenyloxolane
PubChem CID10775525
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name(2S,4R)-2,4-diphenyloxolane
SMILESc1ccc([C@@H]2CO[C@H](c3ccccc3)C2)cc1
InChIInChI=1S/C16H16O/c1-3-7-13(8-4-1)15-11-16(17-12-15)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2/t15-,16-/m0/s1
InChIKeyDTRWVAWUKAYYNM-HOTGVXAUSA-N
XLogP3.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Dibenzyl ether
CID 7657
Benzyl octyl ether
CID 347508
Bis(1-phenylethyl) ether
CID 62342
Isoamyl benzyl ether
CID 31227
2,2-Diphenyltetrahydrofuran
CID 70175
Methyl trityl ether
CID 136388
Benzene, (1-ethoxyethyl)-
CID 18693
Ethyl trityl ether
CID 294563
2H-Pyran, 3,6-dihydro-4-methyl-2-phenyl-
CID 108443
2H-Pyran, tetrahydro-4-methylene-2-phenyl-
CID 108444
2H-Pyran, tetrahydro-4-methyl-2-phenyl-, (2R,4S)-rel-
CID 15640305
2H-Pyran, tetrahydro-4-methyl-2-phenyl-, (2R,4R)-rel-
CID 15640306

Frequently Asked Questions

What is the IUPAC name of (2S,4R)-2,4-diphenyloxolane?
The IUPAC name of (2S,4R)-2,4-diphenyloxolane (CID 10775525) is (2S,4R)-2,4-diphenyloxolane.
What is the SMILES notation for (2S,4R)-2,4-diphenyloxolane?
The canonical SMILES for (2S,4R)-2,4-diphenyloxolane is c1ccc([C@@H]2CO[C@H](c3ccccc3)C2)cc1.
What is the InChIKey of (2S,4R)-2,4-diphenyloxolane?
The InChIKey is DTRWVAWUKAYYNM-HOTGVXAUSA-N. The full InChI is InChI=1S/C16H16O/c1-3-7-13(8-4-1)15-11-16(17-12-15)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2/t15-,16-/m0/s1.
What are the key properties of (2S,4R)-2,4-diphenyloxolane?
(2S,4R)-2,4-diphenyloxolane has a molecular weight of 224.30 g/mol, XLogP of 3.93, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4R)-2,4-diphenyloxolane is sourced from PubChem (CID 10775525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).