2,3,4-trimethyl-2-propoxyoxolane

C10H20O2 — CID 67558008

IUPAC2,3,4-trimethyl-2-propoxyoxolane
SMILESCCCOC1(C)OCC(C)C1C
InChIInChI=1S/C10H20O2/c1-5-6-11-10(4)9(3)8(2)7-12-10/h8-9H,5-7H2,1-4H3
InChIKeyBGHGSSPRPWVFDY-UHFFFAOYSA-N
MW172.27 g/mol
LogP2.43
Rot. Bonds3

About 2,3,4-trimethyl-2-propoxyoxolane

2,3,4-trimethyl-2-propoxyoxolane (PubChem CID 67558008) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 2,3,4-trimethyl-2-propoxyoxolane.

Molecular Properties

Compound Name2,3,4-trimethyl-2-propoxyoxolane
PubChem CID67558008
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name2,3,4-trimethyl-2-propoxyoxolane
SMILESCCCOC1(C)OCC(C)C1C
InChIInChI=1S/C10H20O2/c1-5-6-11-10(4)9(3)8(2)7-12-10/h8-9H,5-7H2,1-4H3
InChIKeyBGHGSSPRPWVFDY-UHFFFAOYSA-N
XLogP2.43
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-Ethyltetrahydro-2,5-dimethoxyfuran
CID 3022858
2-Ethoxy-5-fluoro-2,4-dimethyloxolane
CID 59010330
5-Fluoro-2,4-dimethyl-2-propoxy-3-(trifluoromethyl)oxolane
CID 59010339
5-Fluoro-2,4-dimethyl-2-propoxyoxolane
CID 59010344
(4S)-4-[(2R)-3-fluoro-3-methylbutan-2-yl]-2,2-dimethyl-1,3-dioxolane
CID 89090354
5-Butoxy-2,2,3-trimethyloxolane
CID 12007913
(5R)-5-ethoxy-2,2-di(propan-2-yl)oxolane
CID 46863241
5-Butoxy-2-ethyl-3-methyloxolane
CID 164686404
2,5-Dimethoxy-3-propan-2-yloxolane
CID 45096633
(2R,3S)-2-ethyl-5-methoxy-3-methyloxolane
CID 10654332
2-Ethoxy-3-(1-ethoxyethyl)oxolane
CID 11769288
2-Ethoxy-5-methyl-3-propan-2-yloxolane
CID 12218396

Frequently Asked Questions

What is the IUPAC name of 2,3,4-trimethyl-2-propoxyoxolane?
The IUPAC name of 2,3,4-trimethyl-2-propoxyoxolane (CID 67558008) is 2,3,4-trimethyl-2-propoxyoxolane.
What is the SMILES notation for 2,3,4-trimethyl-2-propoxyoxolane?
The canonical SMILES for 2,3,4-trimethyl-2-propoxyoxolane is CCCOC1(C)OCC(C)C1C.
What is the InChIKey of 2,3,4-trimethyl-2-propoxyoxolane?
The InChIKey is BGHGSSPRPWVFDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-5-6-11-10(4)9(3)8(2)7-12-10/h8-9H,5-7H2,1-4H3.
What are the key properties of 2,3,4-trimethyl-2-propoxyoxolane?
2,3,4-trimethyl-2-propoxyoxolane has a molecular weight of 172.27 g/mol, XLogP of 2.43, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trimethyl-2-propoxyoxolane is sourced from PubChem (CID 67558008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).