(2R,3S)-2,3-bis(2-chlorophenyl)oxirane

C14H10Cl2O — CID 677476

IUPAC(2R,3S)-2,3-bis(2-chlorophenyl)oxirane
SMILESClc1ccccc1[C@H]1O[C@H]1c1ccccc1Cl
InChIInChI=1S/C14H10Cl2O/c15-11-7-3-1-5-9(11)13-14(17-13)10-6-2-4-8-12(10)16/h1-8,13-14H/t13-,14+
InChIKeyCYHHHQOGWYZTGK-OKILXGFUSA-N
MW265.14 g/mol
LogP4.81
Rot. Bonds2

About (2R,3S)-2,3-bis(2-chlorophenyl)oxirane

(2R,3S)-2,3-bis(2-chlorophenyl)oxirane (PubChem CID 677476) has the molecular formula C14H10Cl2O and a molecular weight of 265.14 g/mol. Its IUPAC name is (2R,3S)-2,3-bis(2-chlorophenyl)oxirane.

Molecular Properties

Compound Name(2R,3S)-2,3-bis(2-chlorophenyl)oxirane
PubChem CID677476
Molecular FormulaC14H10Cl2O
Molecular Weight265.14 g/mol
Exact Mass264.01
IUPAC Name(2R,3S)-2,3-bis(2-chlorophenyl)oxirane
SMILESClc1ccccc1[C@H]1O[C@H]1c1ccccc1Cl
InChIInChI=1S/C14H10Cl2O/c15-11-7-3-1-5-9(11)13-14(17-13)10-6-2-4-8-12(10)16/h1-8,13-14H/t13-,14+
InChIKeyCYHHHQOGWYZTGK-OKILXGFUSA-N
XLogP4.81
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.14
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2,3-bis(2-chlorophenyl)oxirane?
The IUPAC name of (2R,3S)-2,3-bis(2-chlorophenyl)oxirane (CID 677476) is (2R,3S)-2,3-bis(2-chlorophenyl)oxirane.
What is the SMILES notation for (2R,3S)-2,3-bis(2-chlorophenyl)oxirane?
The canonical SMILES for (2R,3S)-2,3-bis(2-chlorophenyl)oxirane is Clc1ccccc1[C@H]1O[C@H]1c1ccccc1Cl.
What is the InChIKey of (2R,3S)-2,3-bis(2-chlorophenyl)oxirane?
The InChIKey is CYHHHQOGWYZTGK-OKILXGFUSA-N. The full InChI is InChI=1S/C14H10Cl2O/c15-11-7-3-1-5-9(11)13-14(17-13)10-6-2-4-8-12(10)16/h1-8,13-14H/t13-,14+.
What are the key properties of (2R,3S)-2,3-bis(2-chlorophenyl)oxirane?
(2R,3S)-2,3-bis(2-chlorophenyl)oxirane has a molecular weight of 265.14 g/mol, XLogP of 4.81, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2,3-bis(2-chlorophenyl)oxirane is sourced from PubChem (CID 677476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).