2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole

C10H6ClF2NO2 — CID 71227332

IUPAC2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole
SMILESFC(F)Oc1ccccc1-c1cnc(Cl)o1
InChIInChI=1S/C10H6ClF2NO2/c11-9-14-5-8(15-9)6-3-1-2-4-7(6)16-10(12)13/h1-5,10H
InChIKeyIHBZWEFDSWLQAX-UHFFFAOYSA-N
MW245.61 g/mol
LogP3.60
Rot. Bonds3

About 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole

2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole (PubChem CID 71227332) has the molecular formula C10H6ClF2NO2 and a molecular weight of 245.61 g/mol. Its IUPAC name is 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole.

Molecular Properties

Compound Name2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole
PubChem CID71227332
Molecular FormulaC10H6ClF2NO2
Molecular Weight245.61 g/mol
Exact Mass245.01
IUPAC Name2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole
SMILESFC(F)Oc1ccccc1-c1cnc(Cl)o1
InChIInChI=1S/C10H6ClF2NO2/c11-9-14-5-8(15-9)6-3-1-2-4-7(6)16-10(12)13/h1-5,10H
InChIKeyIHBZWEFDSWLQAX-UHFFFAOYSA-N
XLogP3.60
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.61
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole?
The IUPAC name of 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole (CID 71227332) is 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole.
What is the SMILES notation for 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole?
The canonical SMILES for 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole is FC(F)Oc1ccccc1-c1cnc(Cl)o1.
What is the InChIKey of 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole?
The InChIKey is IHBZWEFDSWLQAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6ClF2NO2/c11-9-14-5-8(15-9)6-3-1-2-4-7(6)16-10(12)13/h1-5,10H.
What are the key properties of 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole?
2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole has a molecular weight of 245.61 g/mol, XLogP of 3.60, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-[2-(difluoromethoxy)phenyl]-1,3-oxazole is sourced from PubChem (CID 71227332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).