cyclopropylmethanesulfonyl chloride

C4H7ClO2S — CID 14106996

IUPACcyclopropylmethanesulfonyl chloride
SMILESO=S(=O)(Cl)CC1CC1
InChIInChI=1S/C4H7ClO2S/c5-8(6,7)3-4-1-2-4/h4H,1-3H2
InChIKeyXJPMSKSCGIBWPC-UHFFFAOYSA-N
MW154.62 g/mol
LogP0.96
Rot. Bonds2

About cyclopropylmethanesulfonyl chloride

cyclopropylmethanesulfonyl chloride (PubChem CID 14106996) has the molecular formula C4H7ClO2S and a molecular weight of 154.62 g/mol. Its IUPAC name is cyclopropylmethanesulfonyl chloride.

Molecular Properties

Compound Namecyclopropylmethanesulfonyl chloride
PubChem CID14106996
Molecular FormulaC4H7ClO2S
Molecular Weight154.62 g/mol
Exact Mass153.99
IUPAC Namecyclopropylmethanesulfonyl chloride
SMILESO=S(=O)(Cl)CC1CC1
InChIInChI=1S/C4H7ClO2S/c5-8(6,7)3-4-1-2-4/h4H,1-3H2
InChIKeyXJPMSKSCGIBWPC-UHFFFAOYSA-N
XLogP0.96
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 ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclopropanesulfonyl chloride
CID 2760919
2-Ethylcyclopropane-1-sulfonyl chloride
CID 55212029
(2,2-Difluorocyclopropyl)methanesulfonyl chloride
CID 55279478
2-Cyclopropylethane-1-sulfonyl chloride
CID 55279594
Cyclopropylmethanesulfonyl fluoride
CID 115011326
(1-Fluorocyclopropyl)methanesulfonyl chloride
CID 125424445
3-Cyclopropylprop-2-yne-1-sulfonyl chloride
CID 137951404
rac-(1R,2R)-2-methylcyclopropane-1-sulfonyl chloride
CID 138987616
2-Methylcyclopropane-1-sulfonyl fluoride
CID 139363295
rac-(1R,2R)-2-methylcyclopropane-1-sulfonyl fluoride
CID 165994789
Cyclopropylmethanesulfinate
CID 17937319
Cyclopropylmethanesulfonic acid
CID 20357275

Frequently Asked Questions

What is the IUPAC name of cyclopropylmethanesulfonyl chloride?
The IUPAC name of cyclopropylmethanesulfonyl chloride (CID 14106996) is cyclopropylmethanesulfonyl chloride.
What is the SMILES notation for cyclopropylmethanesulfonyl chloride?
The canonical SMILES for cyclopropylmethanesulfonyl chloride is O=S(=O)(Cl)CC1CC1.
What is the InChIKey of cyclopropylmethanesulfonyl chloride?
The InChIKey is XJPMSKSCGIBWPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7ClO2S/c5-8(6,7)3-4-1-2-4/h4H,1-3H2.
What are the key properties of cyclopropylmethanesulfonyl chloride?
cyclopropylmethanesulfonyl chloride has a molecular weight of 154.62 g/mol, XLogP of 0.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropylmethanesulfonyl chloride is sourced from PubChem (CID 14106996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).