2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol

C8H16O3 — CID 19745138

IUPAC2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol
SMILESCC(C)(CO)C1(C)OCCO1
InChIInChI=1S/C8H16O3/c1-7(2,6-9)8(3)10-4-5-11-8/h9H,4-6H2,1-3H3
InChIKeyPWPHZRLUZDEUGK-UHFFFAOYSA-N
MW160.21 g/mol
LogP0.77
Rot. Bonds2

About 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol

2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol (PubChem CID 19745138) has the molecular formula C8H16O3 and a molecular weight of 160.21 g/mol. Its IUPAC name is 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol
PubChem CID19745138
Molecular FormulaC8H16O3
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol
SMILESCC(C)(CO)C1(C)OCCO1
InChIInChI=1S/C8H16O3/c1-7(2,6-9)8(3)10-4-5-11-8/h9H,4-6H2,1-3H3
InChIKeyPWPHZRLUZDEUGK-UHFFFAOYSA-N
XLogP0.77
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.21
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol?
The IUPAC name of 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol (CID 19745138) is 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol.
What is the SMILES notation for 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol?
The canonical SMILES for 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol is CC(C)(CO)C1(C)OCCO1.
What is the InChIKey of 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol?
The InChIKey is PWPHZRLUZDEUGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3/c1-7(2,6-9)8(3)10-4-5-11-8/h9H,4-6H2,1-3H3.
What are the key properties of 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol?
2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol has a molecular weight of 160.21 g/mol, XLogP of 0.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-(2-methyl-1,3-dioxolan-2-yl)propan-1-ol is sourced from PubChem (CID 19745138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).