(Z)-1-bromo-2-phenylethenesulfonyl fluoride

C8H6BrFO2S — CID 154718317

IUPAC(Z)-1-bromo-2-phenylethenesulfonyl fluoride
SMILESO=S(=O)(F)/C(Br)=C/c1ccccc1
InChIInChI=1S/C8H6BrFO2S/c9-8(13(10,11)12)6-7-4-2-1-3-5-7/h1-6H/b8-6+
InChIKeyHFHRZXKWTFGCLE-SOFGYWHQSA-N
MW265.10 g/mol
LogP2.68
Rot. Bonds2

About (Z)-1-bromo-2-phenylethenesulfonyl fluoride

(Z)-1-bromo-2-phenylethenesulfonyl fluoride (PubChem CID 154718317) has the molecular formula C8H6BrFO2S and a molecular weight of 265.10 g/mol. Its IUPAC name is (Z)-1-bromo-2-phenylethenesulfonyl fluoride.

Molecular Properties

Compound Name(Z)-1-bromo-2-phenylethenesulfonyl fluoride
PubChem CID154718317
Molecular FormulaC8H6BrFO2S
Molecular Weight265.10 g/mol
Exact Mass263.93
IUPAC Name(Z)-1-bromo-2-phenylethenesulfonyl fluoride
SMILESO=S(=O)(F)/C(Br)=C/c1ccccc1
InChIInChI=1S/C8H6BrFO2S/c9-8(13(10,11)12)6-7-4-2-1-3-5-7/h1-6H/b8-6+
InChIKeyHFHRZXKWTFGCLE-SOFGYWHQSA-N
XLogP2.68
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.10
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-bromo-2-phenylethenesulfonyl fluoride?
The IUPAC name of (Z)-1-bromo-2-phenylethenesulfonyl fluoride (CID 154718317) is (Z)-1-bromo-2-phenylethenesulfonyl fluoride.
What is the SMILES notation for (Z)-1-bromo-2-phenylethenesulfonyl fluoride?
The canonical SMILES for (Z)-1-bromo-2-phenylethenesulfonyl fluoride is O=S(=O)(F)/C(Br)=C/c1ccccc1.
What is the InChIKey of (Z)-1-bromo-2-phenylethenesulfonyl fluoride?
The InChIKey is HFHRZXKWTFGCLE-SOFGYWHQSA-N. The full InChI is InChI=1S/C8H6BrFO2S/c9-8(13(10,11)12)6-7-4-2-1-3-5-7/h1-6H/b8-6+.
What are the key properties of (Z)-1-bromo-2-phenylethenesulfonyl fluoride?
(Z)-1-bromo-2-phenylethenesulfonyl fluoride has a molecular weight of 265.10 g/mol, XLogP of 2.68, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-bromo-2-phenylethenesulfonyl fluoride is sourced from PubChem (CID 154718317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).