2-(3-methylbutan-2-yloxymethyl)oxolane

C10H20O2 — CID 77457674

IUPAC2-(3-methylbutan-2-yloxymethyl)oxolane
SMILESCC(C)C(C)OCC1CCCO1
InChIInChI=1S/C10H20O2/c1-8(2)9(3)12-7-10-5-4-6-11-10/h8-10H,4-7H2,1-3H3
InChIKeyFCMHDMKGGRJIDD-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.23
Rot. Bonds4

About 2-(3-methylbutan-2-yloxymethyl)oxolane

2-(3-methylbutan-2-yloxymethyl)oxolane (PubChem CID 77457674) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 2-(3-methylbutan-2-yloxymethyl)oxolane.

Molecular Properties

Compound Name2-(3-methylbutan-2-yloxymethyl)oxolane
PubChem CID77457674
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name2-(3-methylbutan-2-yloxymethyl)oxolane
SMILESCC(C)C(C)OCC1CCCO1
InChIInChI=1S/C10H20O2/c1-8(2)9(3)12-7-10-5-4-6-11-10/h8-10H,4-7H2,1-3H3
InChIKeyFCMHDMKGGRJIDD-UHFFFAOYSA-N
XLogP2.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(Butoxymethyl)tetrahydrofuran
CID 4581212
Tetrahydrofurfuryl isopropyl ether
CID 13763952
CID 59905782
CID 59905782
2-(tert-Butoxymethyl)oxolane
CID 18618941
3-Ethyl-2-(methoxymethyl)oxolane
CID 140191019
4-Ethyl-2-(methoxymethyl)oxolane
CID 140191131
2-(3-Methylbutoxymethyl)oxolane
CID 144332395
3-Methyl-4-pentoxyoxolane
CID 167227502
Tetrahydrofurfuryloxytriethylstannane
CID 16693195
2-Fluoro-5-(methoxymethyl)-3-methyloxolane
CID 143654852
12-Methyl-12-(oxolan-2-ylmethoxy)-1,4,7,10-tetraoxacyclotridecane
CID 15721737
(3R)-3-methyl-4-propoxyoxolane
CID 142247239

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylbutan-2-yloxymethyl)oxolane?
The IUPAC name of 2-(3-methylbutan-2-yloxymethyl)oxolane (CID 77457674) is 2-(3-methylbutan-2-yloxymethyl)oxolane.
What is the SMILES notation for 2-(3-methylbutan-2-yloxymethyl)oxolane?
The canonical SMILES for 2-(3-methylbutan-2-yloxymethyl)oxolane is CC(C)C(C)OCC1CCCO1.
What is the InChIKey of 2-(3-methylbutan-2-yloxymethyl)oxolane?
The InChIKey is FCMHDMKGGRJIDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-8(2)9(3)12-7-10-5-4-6-11-10/h8-10H,4-7H2,1-3H3.
What are the key properties of 2-(3-methylbutan-2-yloxymethyl)oxolane?
2-(3-methylbutan-2-yloxymethyl)oxolane has a molecular weight of 172.27 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylbutan-2-yloxymethyl)oxolane is sourced from PubChem (CID 77457674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).