[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol

C6H12O3 — CID 736056

IUPAC[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
SMILESCC1(C)OC[C@@H](CO)O1
InChIInChI=1S/C6H12O3/c1-6(2)8-4-5(3-7)9-6/h5,7H,3-4H2,1-2H3/t5-/m1/s1
InChIKeyRNVYQYLELCKWAN-RXMQYKEDSA-N
MW132.16 g/mol
LogP0.13
Rot. Bonds1

About [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol

[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol (PubChem CID 736056) has the molecular formula C6H12O3 and a molecular weight of 132.16 g/mol. Its IUPAC name is [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol.

Molecular Properties

Compound Name[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
PubChem CID736056
Molecular FormulaC6H12O3
Molecular Weight132.16 g/mol
Exact Mass132.08
IUPAC Name[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol
SMILESCC1(C)OC[C@@H](CO)O1
InChIInChI=1S/C6H12O3/c1-6(2)8-4-5(3-7)9-6/h5,7H,3-4H2,1-2H3/t5-/m1/s1
InChIKeyRNVYQYLELCKWAN-RXMQYKEDSA-N
XLogP0.13
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.16
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol?
The IUPAC name of [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol (CID 736056) is [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol.
What is the SMILES notation for [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol?
The canonical SMILES for [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol is CC1(C)OC[C@@H](CO)O1.
What is the InChIKey of [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol?
The InChIKey is RNVYQYLELCKWAN-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H12O3/c1-6(2)8-4-5(3-7)9-6/h5,7H,3-4H2,1-2H3/t5-/m1/s1.
What are the key properties of [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol?
[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol has a molecular weight of 132.16 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]methanol is sourced from PubChem (CID 736056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).