1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride

C7H9ClO5S — CID 147458194

IUPAC1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride
SMILESO=C1OC[C@@H](CC2(S(=O)(=O)Cl)CC2)O1
InChIInChI=1S/C7H9ClO5S/c8-14(10,11)7(1-2-7)3-5-4-12-6(9)13-5/h5H,1-4H2/t5-/m1/s1
InChIKeyDZKIEPNRXHDSBC-RXMQYKEDSA-N
MW240.66 g/mol
LogP1.01
Rot. Bonds3

About 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride

1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride (PubChem CID 147458194) has the molecular formula C7H9ClO5S and a molecular weight of 240.66 g/mol. Its IUPAC name is 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride.

Molecular Properties

Compound Name1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride
PubChem CID147458194
Molecular FormulaC7H9ClO5S
Molecular Weight240.66 g/mol
Exact Mass239.99
IUPAC Name1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride
SMILESO=C1OC[C@@H](CC2(S(=O)(=O)Cl)CC2)O1
InChIInChI=1S/C7H9ClO5S/c8-14(10,11)7(1-2-7)3-5-4-12-6(9)13-5/h5H,1-4H2/t5-/m1/s1
InChIKeyDZKIEPNRXHDSBC-RXMQYKEDSA-N
XLogP1.01
TPSA69.67 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.66
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride?
The IUPAC name of 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride (CID 147458194) is 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride.
What is the SMILES notation for 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride?
The canonical SMILES for 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride is O=C1OC[C@@H](CC2(S(=O)(=O)Cl)CC2)O1.
What is the InChIKey of 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride?
The InChIKey is DZKIEPNRXHDSBC-RXMQYKEDSA-N. The full InChI is InChI=1S/C7H9ClO5S/c8-14(10,11)7(1-2-7)3-5-4-12-6(9)13-5/h5H,1-4H2/t5-/m1/s1.
What are the key properties of 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride?
1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride has a molecular weight of 240.66 g/mol, XLogP of 1.01, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[(4R)-2-oxo-1,3-dioxolan-4-yl]methyl]cyclopropane-1-sulfonyl chloride is sourced from PubChem (CID 147458194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).