(E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride

C8H7FO3S — CID 155521526

IUPAC(E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride
SMILESO=S(=O)(F)/C=C/c1cccc(O)c1
InChIInChI=1S/C8H7FO3S/c9-13(11,12)5-4-7-2-1-3-8(10)6-7/h1-6,10H/b5-4+
InChIKeyKVUOZJWYHCUOMD-SNAWJCMRSA-N
MW202.21 g/mol
LogP1.66
Rot. Bonds2

About (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride

(E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride (PubChem CID 155521526) has the molecular formula C8H7FO3S and a molecular weight of 202.21 g/mol. Its IUPAC name is (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride.

Molecular Properties

Compound Name(E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride
PubChem CID155521526
Molecular FormulaC8H7FO3S
Molecular Weight202.21 g/mol
Exact Mass202.01
IUPAC Name(E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride
SMILESO=S(=O)(F)/C=C/c1cccc(O)c1
InChIInChI=1S/C8H7FO3S/c9-13(11,12)5-4-7-2-1-3-8(10)6-7/h1-6,10H/b5-4+
InChIKeyKVUOZJWYHCUOMD-SNAWJCMRSA-N
XLogP1.66
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-Hydroxyphenyl)Pentanesulfonyl Fluoride
CID 25017608
phenyl (E)-2-phenylethenesulfonate
CID 1551564
Phenol, 3-ethenyl-
CID 3013921
2,2-Dioxo-1,2lambda6-benzoxathiin-6-ol
CID 71717570
7-(2-Hydroxy-phenyl)-heptanesulfonyl fluoride
CID 23725185
7-(4-Hydroxy-phenyl)-heptanesulfonyl fluoride
CID 25017348
7-(3-Hydroxy-phenyl)-heptanesulfonyl fluoride
CID 25017607
3-(Trifluoromethyl)phenyl trifluoromethanesulphonate
CID 10685169
m-Tolyl 2-phenylethenesulfonate
CID 6270191
3-(Trifluoromethyl)phenyl methanesulfonate
CID 269610
(E)-2-(4-hydroxyphenyl)ethenesulfonyl fluoride
CID 155545682
3-Tolyl trifluoromethanesulfonate
CID 572021

Frequently Asked Questions

What is the IUPAC name of (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride?
The IUPAC name of (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride (CID 155521526) is (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride.
What is the SMILES notation for (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride?
The canonical SMILES for (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride is O=S(=O)(F)/C=C/c1cccc(O)c1.
What is the InChIKey of (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride?
The InChIKey is KVUOZJWYHCUOMD-SNAWJCMRSA-N. The full InChI is InChI=1S/C8H7FO3S/c9-13(11,12)5-4-7-2-1-3-8(10)6-7/h1-6,10H/b5-4+.
What are the key properties of (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride?
(E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride has a molecular weight of 202.21 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-(3-hydroxyphenyl)ethenesulfonyl fluoride is sourced from PubChem (CID 155521526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).