[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride

C10H7ClFNO3S — CID 165479251

IUPAC[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride
SMILESO=S(=O)(Cl)Cc1cc(-c2ccccc2F)on1
InChIInChI=1S/C10H7ClFNO3S/c11-17(14,15)6-7-5-10(16-13-7)8-3-1-2-4-9(8)12/h1-5H,6H2
InChIKeyRNKJNBLEWREQEO-UHFFFAOYSA-N
MW275.69 g/mol
LogP2.55
Rot. Bonds3

About [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride

[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride (PubChem CID 165479251) has the molecular formula C10H7ClFNO3S and a molecular weight of 275.69 g/mol. Its IUPAC name is [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride.

Molecular Properties

Compound Name[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride
PubChem CID165479251
Molecular FormulaC10H7ClFNO3S
Molecular Weight275.69 g/mol
Exact Mass274.98
IUPAC Name[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride
SMILESO=S(=O)(Cl)Cc1cc(-c2ccccc2F)on1
InChIInChI=1S/C10H7ClFNO3S/c11-17(14,15)6-7-5-10(16-13-7)8-3-1-2-4-9(8)12/h1-5H,6H2
InChIKeyRNKJNBLEWREQEO-UHFFFAOYSA-N
XLogP2.55
TPSA60.17 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.69
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide
CID 27370057
5-(2-fluorophenyl)-3-(tetrazol-1-ylmethyl)-1,2-oxazole
CID 167966388
[5-(3-methoxyphenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride
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[5-(4-nitrophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride
CID 165472182
[5-(4-propylphenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride
CID 165472179
5-(2-fluorophenyl)-3-(trifluoromethyl)-1,2-oxazole
CID 116861916
N-[2-[1-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]triazol-4-yl]propan-2-yl]methanesulfonamide
CID 167842718
2-[5-(2-fluorophenyl)-1,2-oxazol-3-yl]-N-pyridin-3-ylacetamide
CID 30850510
N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide
CID 27370099
5-(2-fluorophenyl)-N-phenyl-1,2-oxazole-3-carboxamide
CID 46480950
[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl 4-morpholin-4-ylsulfonylbenzoate
CID 27370210
5-(2-fluorophenyl)-N,N-dimethyl-1,2-oxazole-3-carboxamide
CID 37338212

Frequently Asked Questions

What is the IUPAC name of [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride?
The IUPAC name of [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride (CID 165479251) is [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride.
What is the SMILES notation for [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride?
The canonical SMILES for [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride is O=S(=O)(Cl)Cc1cc(-c2ccccc2F)on1.
What is the InChIKey of [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride?
The InChIKey is RNKJNBLEWREQEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClFNO3S/c11-17(14,15)6-7-5-10(16-13-7)8-3-1-2-4-9(8)12/h1-5H,6H2.
What are the key properties of [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride?
[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride has a molecular weight of 275.69 g/mol, XLogP of 2.55, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-fluorophenyl)-1,2-oxazol-3-yl]methanesulfonyl chloride is sourced from PubChem (CID 165479251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).