2-fluoro-1,3-thiazole-5-sulfonyl chloride

C3HClFNO2S2 — CID 170949440

IUPAC2-fluoro-1,3-thiazole-5-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cnc(F)s1
InChIInChI=1S/C3HClFNO2S2/c4-10(7,8)2-1-6-3(5)9-2/h1H
InChIKeyIZMUFEBKLLYNKC-UHFFFAOYSA-N
MW201.63 g/mol
LogP1.21
Rot. Bonds1

About 2-fluoro-1,3-thiazole-5-sulfonyl chloride

2-fluoro-1,3-thiazole-5-sulfonyl chloride (PubChem CID 170949440) has the molecular formula C3HClFNO2S2 and a molecular weight of 201.63 g/mol. Its IUPAC name is 2-fluoro-1,3-thiazole-5-sulfonyl chloride.

Molecular Properties

Compound Name2-fluoro-1,3-thiazole-5-sulfonyl chloride
PubChem CID170949440
Molecular FormulaC3HClFNO2S2
Molecular Weight201.63 g/mol
Exact Mass200.91
IUPAC Name2-fluoro-1,3-thiazole-5-sulfonyl chloride
SMILESO=S(=O)(Cl)c1cnc(F)s1
InChIInChI=1S/C3HClFNO2S2/c4-10(7,8)2-1-6-3(5)9-2/h1H
InChIKeyIZMUFEBKLLYNKC-UHFFFAOYSA-N
XLogP1.21
TPSA47.03 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.63
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-Thiazole-5-sulfonamide
CID 23075930
1,3-Thiazole-5-sulfonyl chloride
CID 53767412
2-Chloro-1,3-thiazole-5-sulfonamide
CID 22019518
2-Chloro-1,3-thiazole-5-sulfonyl chloride
CID 16228943
2-Thiazolesulfonyl fluoride
CID 16427159
2-Methyl-1,3-thiazole-5-sulfonyl chloride
CID 53441758
2-Ethoxy-1,3-thiazole-5-sulfonyl chloride
CID 90273940
2-(1,1-Difluoroethyl)-1,3-thiazole-5-sulfonylchloride
CID 155973595
2-Methoxy-1,3-thiazole-5-sulfonyl fluoride
CID 122235983
5-Thiazolesulfonyl fluoride, 2-methyl-
CID 125454234
2-Chloro-1,3-thiazole-5-sulfonyl fluoride
CID 165453591
1,3-Thiazole-5-sulfonic acid
CID 13899663

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1,3-thiazole-5-sulfonyl chloride?
The IUPAC name of 2-fluoro-1,3-thiazole-5-sulfonyl chloride (CID 170949440) is 2-fluoro-1,3-thiazole-5-sulfonyl chloride.
What is the SMILES notation for 2-fluoro-1,3-thiazole-5-sulfonyl chloride?
The canonical SMILES for 2-fluoro-1,3-thiazole-5-sulfonyl chloride is O=S(=O)(Cl)c1cnc(F)s1.
What is the InChIKey of 2-fluoro-1,3-thiazole-5-sulfonyl chloride?
The InChIKey is IZMUFEBKLLYNKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C3HClFNO2S2/c4-10(7,8)2-1-6-3(5)9-2/h1H.
What are the key properties of 2-fluoro-1,3-thiazole-5-sulfonyl chloride?
2-fluoro-1,3-thiazole-5-sulfonyl chloride has a molecular weight of 201.63 g/mol, XLogP of 1.21, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1,3-thiazole-5-sulfonyl chloride is sourced from PubChem (CID 170949440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).