[(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone

C17H15ClO2 — CID 10266040

IUPAC[(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone
SMILESO=C(c1ccccc1)[C@@H]1CCO[C@H]1c1ccc(Cl)cc1
InChIInChI=1S/C17H15ClO2/c18-14-8-6-13(7-9-14)17-15(10-11-20-17)16(19)12-4-2-1-3-5-12/h1-9,15,17H,10-11H2/t15-,17-/m0/s1
InChIKeyOTELXXMXKQNWDD-RDJZCZTQSA-N
MW286.76 g/mol
LogP4.30
Rot. Bonds3

About [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone

[(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone (PubChem CID 10266040) has the molecular formula C17H15ClO2 and a molecular weight of 286.76 g/mol. Its IUPAC name is [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone.

Molecular Properties

Compound Name[(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone
PubChem CID10266040
Molecular FormulaC17H15ClO2
Molecular Weight286.76 g/mol
Exact Mass286.08
IUPAC Name[(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone
SMILESO=C(c1ccccc1)[C@@H]1CCO[C@H]1c1ccc(Cl)cc1
InChIInChI=1S/C17H15ClO2/c18-14-8-6-13(7-9-14)17-15(10-11-20-17)16(19)12-4-2-1-3-5-12/h1-9,15,17H,10-11H2/t15-,17-/m0/s1
InChIKeyOTELXXMXKQNWDD-RDJZCZTQSA-N
XLogP4.30
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.76
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

phenyl-(2-phenyloxolan-3-yl)methanone
CID 73097073
[(2S,3R)-2-(4-nitrophenyl)oxolan-3-yl]-phenylmethanone
CID 11779363
[(1R,2R)-2-(4-chlorophenyl)cyclopropyl]-phenylmethanone
CID 27327097
2-(4-cyclopropylphenyl)oxolane-3-carboxylic acid
CID 79978253
[4-benzoyl-5-(4-chlorophenyl)-1-methylpyrrolidin-3-yl]-phenylmethanone
CID 3535886
(2S,3R)-2,3-bis(4-chlorophenyl)-1,4-dioxane
CID 71365494
2-phenyloxolane-3-carbohydrazide
CID 122235516
N-[2-(4-chlorophenyl)oxolan-3-yl]-2-hydroxycyclopentane-1-carboxamide
CID 110016794
[(1S,2S)-2-(4-chlorophenyl)-4-(morpholine-4-carbonyl)cyclopent-3-en-1-yl]-phenylmethanone
CID 53306857
[(1R,2R)-2-benzoylcyclopropyl]-phenylmethanone
CID 12564065
[(4S,5R)-5-(4-chlorophenyl)-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl]-phenylmethanone
CID 139221418
2-(4-chlorobenzoyl)cyclopentane-1-carboxylic acid
CID 53411598

Frequently Asked Questions

What is the IUPAC name of [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone?
The IUPAC name of [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone (CID 10266040) is [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone.
What is the SMILES notation for [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone?
The canonical SMILES for [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone is O=C(c1ccccc1)[C@@H]1CCO[C@H]1c1ccc(Cl)cc1.
What is the InChIKey of [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone?
The InChIKey is OTELXXMXKQNWDD-RDJZCZTQSA-N. The full InChI is InChI=1S/C17H15ClO2/c18-14-8-6-13(7-9-14)17-15(10-11-20-17)16(19)12-4-2-1-3-5-12/h1-9,15,17H,10-11H2/t15-,17-/m0/s1.
What are the key properties of [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone?
[(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone has a molecular weight of 286.76 g/mol, XLogP of 4.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3R)-2-(4-chlorophenyl)oxolan-3-yl]-phenylmethanone is sourced from PubChem (CID 10266040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).