(4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane

C11H22O2 — CID 176679204

IUPAC(4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane
SMILESCOC1(C)[C@H](C)COC1(C)C(C)C
InChIInChI=1S/C11H22O2/c1-8(2)10(4)11(5,12-6)9(3)7-13-10/h8-9H,7H2,1-6H3/t9-,10?,11?/m1/s1
InChIKeyIGNMMOWMKKVPNK-KPPDAEKUSA-N
MW186.29 g/mol
LogP2.47
Rot. Bonds2

About (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane

(4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane (PubChem CID 176679204) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane.

Molecular Properties

Compound Name(4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane
PubChem CID176679204
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name(4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane
SMILESCOC1(C)[C@H](C)COC1(C)C(C)C
InChIInChI=1S/C11H22O2/c1-8(2)10(4)11(5,12-6)9(3)7-13-10/h8-9H,7H2,1-6H3/t9-,10?,11?/m1/s1
InChIKeyIGNMMOWMKKVPNK-KPPDAEKUSA-N
XLogP2.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane?
The IUPAC name of (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane (CID 176679204) is (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane.
What is the SMILES notation for (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane?
The canonical SMILES for (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane is COC1(C)[C@H](C)COC1(C)C(C)C.
What is the InChIKey of (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane?
The InChIKey is IGNMMOWMKKVPNK-KPPDAEKUSA-N. The full InChI is InChI=1S/C11H22O2/c1-8(2)10(4)11(5,12-6)9(3)7-13-10/h8-9H,7H2,1-6H3/t9-,10?,11?/m1/s1.
What are the key properties of (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane?
(4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane has a molecular weight of 186.29 g/mol, XLogP of 2.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3-methoxy-2,3,4-trimethyl-2-propan-2-yloxolane is sourced from PubChem (CID 176679204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).