(2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane

C10H20O2 — CID 89274647

IUPAC(2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane
SMILESCO[C@]1(C)C[C@H](C)O[C@@H](C)[C@@H]1C
InChIInChI=1S/C10H20O2/c1-7-6-10(4,11-5)8(2)9(3)12-7/h7-9H,6H2,1-5H3/t7-,8-,9-,10+/m0/s1
InChIKeyRAVFTDCCDVNJEF-AATLWQCWSA-N
MW172.27 g/mol
LogP2.22
Rot. Bonds1

About (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane

(2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane (PubChem CID 89274647) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane.

Molecular Properties

Compound Name(2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane
PubChem CID89274647
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name(2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane
SMILESCO[C@]1(C)C[C@H](C)O[C@@H](C)[C@@H]1C
InChIInChI=1S/C10H20O2/c1-7-6-10(4,11-5)8(2)9(3)12-7/h7-9H,6H2,1-5H3/t7-,8-,9-,10+/m0/s1
InChIKeyRAVFTDCCDVNJEF-AATLWQCWSA-N
XLogP2.22
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane?
The IUPAC name of (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane (CID 89274647) is (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane.
What is the SMILES notation for (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane?
The canonical SMILES for (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane is CO[C@]1(C)C[C@H](C)O[C@@H](C)[C@@H]1C.
What is the InChIKey of (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane?
The InChIKey is RAVFTDCCDVNJEF-AATLWQCWSA-N. The full InChI is InChI=1S/C10H20O2/c1-7-6-10(4,11-5)8(2)9(3)12-7/h7-9H,6H2,1-5H3/t7-,8-,9-,10+/m0/s1.
What are the key properties of (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane?
(2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane has a molecular weight of 172.27 g/mol, XLogP of 2.22, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S,4R,6S)-4-methoxy-2,3,4,6-tetramethyloxane is sourced from PubChem (CID 89274647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).