2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane

C17H32O2 — CID 18363641

IUPAC2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane
SMILESCC1OC(C(C)(C)C2OC(C)C(C)C2C)C(C)C1C
InChIInChI=1S/C17H32O2/c1-9-11(3)15(18-13(9)5)17(7,8)16-12(4)10(2)14(6)19-16/h9-16H,1-8H3
InChIKeyAMXBYNWSJUHADD-UHFFFAOYSA-N
MW268.44 g/mol
LogP4.13
Rot. Bonds2

About 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane

2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane (PubChem CID 18363641) has the molecular formula C17H32O2 and a molecular weight of 268.44 g/mol. Its IUPAC name is 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane.

Molecular Properties

Compound Name2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane
PubChem CID18363641
Molecular FormulaC17H32O2
Molecular Weight268.44 g/mol
Exact Mass268.24
IUPAC Name2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane
SMILESCC1OC(C(C)(C)C2OC(C)C(C)C2C)C(C)C1C
InChIInChI=1S/C17H32O2/c1-9-11(3)15(18-13(9)5)17(7,8)16-12(4)10(2)14(6)19-16/h9-16H,1-8H3
InChIKeyAMXBYNWSJUHADD-UHFFFAOYSA-N
XLogP4.13
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane?
The IUPAC name of 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane (CID 18363641) is 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane.
What is the SMILES notation for 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane?
The canonical SMILES for 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane is CC1OC(C(C)(C)C2OC(C)C(C)C2C)C(C)C1C.
What is the InChIKey of 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane?
The InChIKey is AMXBYNWSJUHADD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O2/c1-9-11(3)15(18-13(9)5)17(7,8)16-12(4)10(2)14(6)19-16/h9-16H,1-8H3.
What are the key properties of 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane?
2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane has a molecular weight of 268.44 g/mol, XLogP of 4.13, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethyl-5-[2-(3,4,5-trimethyloxolan-2-yl)propan-2-yl]oxolane is sourced from PubChem (CID 18363641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).