(2S)-2,3-dimethoxypropane-1-sulfonyl chloride

C5H11ClO4S — CID 125424530

IUPAC(2S)-2,3-dimethoxypropane-1-sulfonyl chloride
SMILESCOC[C@@H](CS(=O)(=O)Cl)OC
InChIInChI=1S/C5H11ClO4S/c1-9-3-5(10-2)4-11(6,7)8/h5H,3-4H2,1-2H3/t5-/m0/s1
InChIKeyNZRWKUFLBBONMX-YFKPBYRVSA-N
MW202.66 g/mol
LogP0.22
Rot. Bonds5

About (2S)-2,3-dimethoxypropane-1-sulfonyl chloride

(2S)-2,3-dimethoxypropane-1-sulfonyl chloride (PubChem CID 125424530) has the molecular formula C5H11ClO4S and a molecular weight of 202.66 g/mol. Its IUPAC name is (2S)-2,3-dimethoxypropane-1-sulfonyl chloride.

Molecular Properties

Compound Name(2S)-2,3-dimethoxypropane-1-sulfonyl chloride
PubChem CID125424530
Molecular FormulaC5H11ClO4S
Molecular Weight202.66 g/mol
Exact Mass202.01
IUPAC Name(2S)-2,3-dimethoxypropane-1-sulfonyl chloride
SMILESCOC[C@@H](CS(=O)(=O)Cl)OC
InChIInChI=1S/C5H11ClO4S/c1-9-3-5(10-2)4-11(6,7)8/h5H,3-4H2,1-2H3/t5-/m0/s1
InChIKeyNZRWKUFLBBONMX-YFKPBYRVSA-N
XLogP0.22
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.66
LogP ≤ 50.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-Methoxypropan-2-yl methanesulfonate
CID 97920
2-(2-Methoxyethoxy)ethane-1-sulfonyl chloride
CID 52983809
2-(Propan-2-yloxy)ethane-1-sulfonyl chloride
CID 56828872
2-(2-(2-Methoxyethoxy)ethoxy)ethane-1-sulfonyl chloride
CID 64197959
2-Methoxypropane-1-sulfonyl chloride
CID 71757010
2-(1,4-Dioxan-2-yl)ethane-1-sulfonyl chloride
CID 131424063
2-Methoxyethyl ethanesulfonate
CID 246385
3-(Propan-2-yloxy)propane-1-sulfonyl chloride
CID 64198864
2-(Oxetan-3-yloxy)ethane-1-sulfonyl chloride
CID 102608496
3-Methoxybutane-1-sulfonyl chloride
CID 115650250
2,3-Dimethoxypropane-1-sulfonyl chloride
CID 122164421
rac-(3R,4S)-4-methoxyoxolane-3-sulfonyl chloride
CID 124710168

Frequently Asked Questions

What is the IUPAC name of (2S)-2,3-dimethoxypropane-1-sulfonyl chloride?
The IUPAC name of (2S)-2,3-dimethoxypropane-1-sulfonyl chloride (CID 125424530) is (2S)-2,3-dimethoxypropane-1-sulfonyl chloride.
What is the SMILES notation for (2S)-2,3-dimethoxypropane-1-sulfonyl chloride?
The canonical SMILES for (2S)-2,3-dimethoxypropane-1-sulfonyl chloride is COC[C@@H](CS(=O)(=O)Cl)OC.
What is the InChIKey of (2S)-2,3-dimethoxypropane-1-sulfonyl chloride?
The InChIKey is NZRWKUFLBBONMX-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H11ClO4S/c1-9-3-5(10-2)4-11(6,7)8/h5H,3-4H2,1-2H3/t5-/m0/s1.
What are the key properties of (2S)-2,3-dimethoxypropane-1-sulfonyl chloride?
(2S)-2,3-dimethoxypropane-1-sulfonyl chloride has a molecular weight of 202.66 g/mol, XLogP of 0.22, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2,3-dimethoxypropane-1-sulfonyl chloride is sourced from PubChem (CID 125424530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).