2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane

C7H14O3 — CID 23262085

IUPAC2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane
SMILESCC(C)(C)OC1OCCO1
InChIInChI=1S/C7H14O3/c1-7(2,3)10-6-8-4-5-9-6/h6H,4-5H2,1-3H3
InChIKeyDUKVVOVOTPMVJA-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.13
Rot. Bonds1

About 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane

2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane (PubChem CID 23262085) has the molecular formula C7H14O3 and a molecular weight of 146.19 g/mol. Its IUPAC name is 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane.

Molecular Properties

Compound Name2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane
PubChem CID23262085
Molecular FormulaC7H14O3
Molecular Weight146.19 g/mol
Exact Mass146.09
IUPAC Name2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane
SMILESCC(C)(C)OC1OCCO1
InChIInChI=1S/C7H14O3/c1-7(2,3)10-6-8-4-5-9-6/h6H,4-5H2,1-3H3
InChIKeyDUKVVOVOTPMVJA-UHFFFAOYSA-N
XLogP1.13
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S,3aR,6S,6aR)-3,6-bis[(2-methylpropan-2-yl)oxy]-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 139315398
6-[(2-methylpropan-2-yl)oxy]-3,6-dihydro-2H-pyran
CID 14202471
7,12-bis[(2-methylpropan-2-yl)oxy]heptacyclo[6.6.0.02,6.03,13.04,11.05,9.010,14]tetradecane
CID 14220126
trans-(1R,2R)-1,2-bis[(2-methylpropan-2-yl)oxy]cyclobutane
CID 66800520
(2S,3R)-3-chloro-2-[(2-methylpropan-2-yl)oxy]oxane
CID 71399470
2-(1,1-dimethoxyethyl)-1,3-dioxolane
CID 57296268
(2R)-3-[(2-methylpropan-2-yl)oxy]-2-[(2-methylpropan-2-yl)oxymethyl]oxane
CID 170102403
(3R,3aR,6S,6aR)-6-[(2-methylpropan-2-yl)oxy]-3-propan-2-yloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 139315328
(2S)-4-(azetidin-3-yl)-2-[(2-methylpropan-2-yl)oxy]morpholine
CID 58469905
CID 174121542
CID 174121542
2-hydroperoxy-2-methylpropane;2-methyloxirane
CID 158620192
2-[2-(oxan-2-yloxy)propan-2-yloxy]oxane
CID 18680583

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane?
The IUPAC name of 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane (CID 23262085) is 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane.
What is the SMILES notation for 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane?
The canonical SMILES for 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane is CC(C)(C)OC1OCCO1.
What is the InChIKey of 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane?
The InChIKey is DUKVVOVOTPMVJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O3/c1-7(2,3)10-6-8-4-5-9-6/h6H,4-5H2,1-3H3.
What are the key properties of 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane?
2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane has a molecular weight of 146.19 g/mol, XLogP of 1.13, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpropan-2-yl)oxy]-1,3-dioxolane is sourced from PubChem (CID 23262085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).