butylsulfonylchloranium

C4H10ClO2S+ — CID 20752756

IUPACbutylsulfonylchloranium
SMILESCCCCS(=O)(=O)[ClH+]
InChIInChI=1S/C4H10ClO2S/c1-2-3-4-8(5,6)7/h5H,2-4H2,1H3/q+1
InChIKeyHFGAKXGMFMNGJF-UHFFFAOYSA-N
MW157.64 g/mol
LogP0.40
Rot. Bonds3

About butylsulfonylchloranium

butylsulfonylchloranium (PubChem CID 20752756) has the molecular formula C4H10ClO2S+ and a molecular weight of 157.64 g/mol. Its IUPAC name is butylsulfonylchloranium.

Molecular Properties

Compound Namebutylsulfonylchloranium
PubChem CID20752756
Molecular FormulaC4H10ClO2S+
Molecular Weight157.64 g/mol
Exact Mass157.01
IUPAC Namebutylsulfonylchloranium
SMILESCCCCS(=O)(=O)[ClH+]
InChIInChI=1S/C4H10ClO2S/c1-2-3-4-8(5,6)7/h5H,2-4H2,1H3/q+1
InChIKeyHFGAKXGMFMNGJF-UHFFFAOYSA-N
XLogP0.40
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.64
LogP ≤ 50.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-methylbutane-1-sulfonamide;hydrochloride
CID 141278218
calcium;1-butylsulfonylbutane;dichloride
CID 174621632
1-ethylsulfonylsulfonylbutane
CID 141390802
lithium butylsulfonylazanide
CID 141349237
lithium butane-1-sulfonate
CID 23684871
CID 172853428
CID 172853428
butyl-methyl-methylidene-oxo-λ6-sulfane
CID 87419750
butane-1-sulfonic acid;sulfane
CID 174687882
aluminum tris(butane-1-sulfonate)
CID 158588198
butane-1-sulfonamide;dihydrochloride
CID 140980497
CID 175918224
CID 175918224
CID 172750944
CID 172750944

Frequently Asked Questions

What is the IUPAC name of butylsulfonylchloranium?
The IUPAC name of butylsulfonylchloranium (CID 20752756) is butylsulfonylchloranium.
What is the SMILES notation for butylsulfonylchloranium?
The canonical SMILES for butylsulfonylchloranium is CCCCS(=O)(=O)[ClH+].
What is the InChIKey of butylsulfonylchloranium?
The InChIKey is HFGAKXGMFMNGJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10ClO2S/c1-2-3-4-8(5,6)7/h5H,2-4H2,1H3/q+1.
What are the key properties of butylsulfonylchloranium?
butylsulfonylchloranium has a molecular weight of 157.64 g/mol, XLogP of 0.40, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butylsulfonylchloranium is sourced from PubChem (CID 20752756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).