(3R)-3-cyclohexyloxythiolane 1,1-dioxide

C10H18O3S — CID 7039067

IUPAC(3R)-3-cyclohexyloxythiolane 1,1-dioxide
SMILESO=S1(=O)CC[C@@H](OC2CCCCC2)C1
InChIInChI=1S/C10H18O3S/c11-14(12)7-6-10(8-14)13-9-4-2-1-3-5-9/h9-10H,1-8H2/t10-/m1/s1
InChIKeyMDUJHYSQQKZZLX-SNVBAGLBSA-N
MW218.32 g/mol
LogP1.52
Rot. Bonds2

About (3R)-3-cyclohexyloxythiolane 1,1-dioxide

(3R)-3-cyclohexyloxythiolane 1,1-dioxide (PubChem CID 7039067) has the molecular formula C10H18O3S and a molecular weight of 218.32 g/mol. Its IUPAC name is (3R)-3-cyclohexyloxythiolane 1,1-dioxide.

Molecular Properties

Compound Name(3R)-3-cyclohexyloxythiolane 1,1-dioxide
PubChem CID7039067
Molecular FormulaC10H18O3S
Molecular Weight218.32 g/mol
Exact Mass218.10
IUPAC Name(3R)-3-cyclohexyloxythiolane 1,1-dioxide
SMILESO=S1(=O)CC[C@@H](OC2CCCCC2)C1
InChIInChI=1S/C10H18O3S/c11-14(12)7-6-10(8-14)13-9-4-2-1-3-5-9/h9-10H,1-8H2/t10-/m1/s1
InChIKeyMDUJHYSQQKZZLX-SNVBAGLBSA-N
XLogP1.52
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-cyclohexyloxythiolane 1,1-dioxide
CID 4585423
CID 173424592
CID 173424592
(1,1-dioxothiolan-3-yl) formate
CID 90943234
bis(1,1-dioxothiolan-3-yl) carbonate
CID 2835679
(1,1-dioxothiolan-3-yl) ethenesulfonate
CID 155217659
(3S)-3-ethoxythiolane 1,1-dioxide
CID 40511911
[(3R)-1,1-dioxothiolan-3-yl] sulfate
CID 7058872
(3S)-3-[2-[2-[(3S)-1,1-dioxothiolan-3-yl]oxyethoxy]ethoxy]thiolane 1,1-dioxide
CID 40549365
(1,1-dioxothiolan-3-yl) prop-2-enoate
CID 54012913
(3R)-3-propoxythiolane 1,1-dioxide
CID 51410713
N-(1,1-dioxothian-3-yl)oxymethanamine
CID 105438258
3-prop-2-enylperoxythiolane 1,1-dioxide
CID 135235402

Frequently Asked Questions

What is the IUPAC name of (3R)-3-cyclohexyloxythiolane 1,1-dioxide?
The IUPAC name of (3R)-3-cyclohexyloxythiolane 1,1-dioxide (CID 7039067) is (3R)-3-cyclohexyloxythiolane 1,1-dioxide.
What is the SMILES notation for (3R)-3-cyclohexyloxythiolane 1,1-dioxide?
The canonical SMILES for (3R)-3-cyclohexyloxythiolane 1,1-dioxide is O=S1(=O)CC[C@@H](OC2CCCCC2)C1.
What is the InChIKey of (3R)-3-cyclohexyloxythiolane 1,1-dioxide?
The InChIKey is MDUJHYSQQKZZLX-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H18O3S/c11-14(12)7-6-10(8-14)13-9-4-2-1-3-5-9/h9-10H,1-8H2/t10-/m1/s1.
What are the key properties of (3R)-3-cyclohexyloxythiolane 1,1-dioxide?
(3R)-3-cyclohexyloxythiolane 1,1-dioxide has a molecular weight of 218.32 g/mol, XLogP of 1.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-cyclohexyloxythiolane 1,1-dioxide is sourced from PubChem (CID 7039067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).