(Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride

C9H6ClF3O2S — CID 117265967

IUPAC(Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride
SMILESO=S(=O)(Cl)/C=C\c1ccccc1C(F)(F)F
InChIInChI=1S/C9H6ClF3O2S/c10-16(14,15)6-5-7-3-1-2-4-8(7)9(11,12)13/h1-6H/b6-5-
InChIKeyRGGSNAXSVHZXLS-WAYWQWQTSA-N
MW270.66 g/mol
LogP3.24
Rot. Bonds2

About (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride

(Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride (PubChem CID 117265967) has the molecular formula C9H6ClF3O2S and a molecular weight of 270.66 g/mol. Its IUPAC name is (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride.

Molecular Properties

Compound Name(Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride
PubChem CID117265967
Molecular FormulaC9H6ClF3O2S
Molecular Weight270.66 g/mol
Exact Mass269.97
IUPAC Name(Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride
SMILESO=S(=O)(Cl)/C=C\c1ccccc1C(F)(F)F
InChIInChI=1S/C9H6ClF3O2S/c10-16(14,15)6-5-7-3-1-2-4-8(7)9(11,12)13/h1-6H/b6-5-
InChIKeyRGGSNAXSVHZXLS-WAYWQWQTSA-N
XLogP3.24
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.66
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(E)-2-[(4-bromophenyl)methylsulfonyl]ethenyl]-2-(trifluoromethyl)benzene
CID 22065294
1-[(Z)-prop-1-enyl]-2-(trifluoromethyl)benzene
CID 143260561
(E,1R)-1-(4-chlorophenyl)-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-ol
CID 73333033
(E)-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-amine
CID 54775943
(E)-3-[2-(trifluoromethyl)phenyl]prop-2-en-1-ol
CID 19876981
2-(2-nitrophenyl)ethenesulfonyl chloride
CID 54483886
[(E)-4-[2-(trifluoromethyl)phenyl]but-3-enyl] formate
CID 173173566
1-[2-[(4-chlorophenyl)methylsulfinyl]ethenyl]-2-(trifluoromethyl)benzene
CID 68562385
2,6-bis(trifluoromethyl)benzenesulfonyl chloride
CID 18981651
4-chloro-N-[[2-(trifluoromethyl)phenyl]methylideneamino]benzenesulfonamide
CID 1349846
2,6-dimethyl-4-[(E)-2-[2-(trifluoromethyl)phenyl]ethenyl]phenol
CID 14771913
phenyl (E)-3-[2-(trifluoromethyl)phenyl]prop-2-enoate
CID 122188870

Frequently Asked Questions

What is the IUPAC name of (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride?
The IUPAC name of (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride (CID 117265967) is (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride.
What is the SMILES notation for (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride?
The canonical SMILES for (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride is O=S(=O)(Cl)/C=C\c1ccccc1C(F)(F)F.
What is the InChIKey of (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride?
The InChIKey is RGGSNAXSVHZXLS-WAYWQWQTSA-N. The full InChI is InChI=1S/C9H6ClF3O2S/c10-16(14,15)6-5-7-3-1-2-4-8(7)9(11,12)13/h1-6H/b6-5-.
What are the key properties of (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride?
(Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride has a molecular weight of 270.66 g/mol, XLogP of 3.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-[2-(trifluoromethyl)phenyl]ethenesulfonyl chloride is sourced from PubChem (CID 117265967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).