(Z)-but-1-ene-1-sulfonyl chloride

C4H7ClO2S — CID 117265958

IUPAC(Z)-but-1-ene-1-sulfonyl chloride
SMILESCC/C=C\S(=O)(=O)Cl
InChIInChI=1S/C4H7ClO2S/c1-2-3-4-8(5,6)7/h3-4H,2H2,1H3/b4-3-
InChIKeyBREMYMWVJQYYFX-ARJAWSKDSA-N
MW154.62 g/mol
LogP1.48
Rot. Bonds2

About (Z)-but-1-ene-1-sulfonyl chloride

(Z)-but-1-ene-1-sulfonyl chloride (PubChem CID 117265958) has the molecular formula C4H7ClO2S and a molecular weight of 154.62 g/mol. Its IUPAC name is (Z)-but-1-ene-1-sulfonyl chloride.

Molecular Properties

Compound Name(Z)-but-1-ene-1-sulfonyl chloride
PubChem CID117265958
Molecular FormulaC4H7ClO2S
Molecular Weight154.62 g/mol
Exact Mass153.99
IUPAC Name(Z)-but-1-ene-1-sulfonyl chloride
SMILESCC/C=C\S(=O)(=O)Cl
InChIInChI=1S/C4H7ClO2S/c1-2-3-4-8(5,6)7/h3-4H,2H2,1H3/b4-3-
InChIKeyBREMYMWVJQYYFX-ARJAWSKDSA-N
XLogP1.48
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.62
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-but-1-enylsulfonylbut-1-ene
CID 123705607
(E)-3-(dimethylamino)prop-1-ene-1-sulfonyl chloride
CID 59361776
(Z)-4-methoxybut-1-ene-1-sulfonyl chloride
CID 117265857
(Z)-4-hydroxybut-1-ene-1-sulfonyl chloride
CID 117265856
(Z)-3-(1-methylpiperidin-2-yl)prop-1-ene-1-sulfonyl chloride
CID 117265916
hex-3-ene;sulfane
CID 174453265
hex-3-ene;hydrochloride
CID 159012047
benzenesulfonic acid;but-1-ene-1-sulfonic acid
CID 162058011
1-chloro-2-ethylsulfonylethene
CID 57135482
(Z)-7-ethylsulfonylhept-3-ene
CID 89382151
carbon dioxide;hex-3-ene;hydrate
CID 175552917
(5E)-octa-3,5-diene
CID 173104147

Frequently Asked Questions

What is the IUPAC name of (Z)-but-1-ene-1-sulfonyl chloride?
The IUPAC name of (Z)-but-1-ene-1-sulfonyl chloride (CID 117265958) is (Z)-but-1-ene-1-sulfonyl chloride.
What is the SMILES notation for (Z)-but-1-ene-1-sulfonyl chloride?
The canonical SMILES for (Z)-but-1-ene-1-sulfonyl chloride is CC/C=C\S(=O)(=O)Cl.
What is the InChIKey of (Z)-but-1-ene-1-sulfonyl chloride?
The InChIKey is BREMYMWVJQYYFX-ARJAWSKDSA-N. The full InChI is InChI=1S/C4H7ClO2S/c1-2-3-4-8(5,6)7/h3-4H,2H2,1H3/b4-3-.
What are the key properties of (Z)-but-1-ene-1-sulfonyl chloride?
(Z)-but-1-ene-1-sulfonyl chloride has a molecular weight of 154.62 g/mol, XLogP of 1.48, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-but-1-ene-1-sulfonyl chloride is sourced from PubChem (CID 117265958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).