(3R)-3-methoxy-4,4-dimethyloxolan-2-ol

C7H14O3 — CID 45082816

IUPAC(3R)-3-methoxy-4,4-dimethyloxolan-2-ol
SMILESCO[C@H]1C(O)OCC1(C)C
InChIInChI=1S/C7H14O3/c1-7(2)4-10-6(8)5(7)9-3/h5-6,8H,4H2,1-3H3/t5-,6?/m0/s1
InChIKeyVFYJKVIPQITLRZ-ZBHICJROSA-N
MW146.19 g/mol
LogP0.38
Rot. Bonds1

About (3R)-3-methoxy-4,4-dimethyloxolan-2-ol

(3R)-3-methoxy-4,4-dimethyloxolan-2-ol (PubChem CID 45082816) has the molecular formula C7H14O3 and a molecular weight of 146.19 g/mol. Its IUPAC name is (3R)-3-methoxy-4,4-dimethyloxolan-2-ol.

Molecular Properties

Compound Name(3R)-3-methoxy-4,4-dimethyloxolan-2-ol
PubChem CID45082816
Molecular FormulaC7H14O3
Molecular Weight146.19 g/mol
Exact Mass146.09
IUPAC Name(3R)-3-methoxy-4,4-dimethyloxolan-2-ol
SMILESCO[C@H]1C(O)OCC1(C)C
InChIInChI=1S/C7H14O3/c1-7(2)4-10-6(8)5(7)9-3/h5-6,8H,4H2,1-3H3/t5-,6?/m0/s1
InChIKeyVFYJKVIPQITLRZ-ZBHICJROSA-N
XLogP0.38
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3S)-4,4-dimethyl-3-[(E)-prop-1-enyl]oxolan-2-ol
CID 141376264
5-methoxyoxane-2,3,4-triol
CID 560177
(1R,2R,3S,5R)-5-methoxy-4,4-dimethylcyclopentane-1,2,3-triol
CID 100924891
2,4,5-trimethoxy-2,4,6-trimethyloxane
CID 152784004
(3R)-3-hydroxy-4,4-dimethyloxolane-2-carbaldehyde
CID 174638920
(1S,2S,4S,5S)-6-methoxycyclohexane-1,2,3,4,5-pentol
CID 7020271
(4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-diol
CID 101384233
(2R,3S,4S,5S,6S)-5-methoxy-6-methyloxane-2,3,4-triol
CID 156614259
(3aS,7R)-7-methoxy-2,2-dimethyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-ol
CID 59047968
(2S,4S)-4-hydroxy-5,5-dimethyl-2-propyloxan-3-one
CID 130891192
5-methoxyoxolane-2,3,4-triol
CID 122494930
4,4,8,8,12,12-hexamethyl-2,6,10-trioxa-13-azatricyclo[7.3.1.05,13]tridecane
CID 11821655

Frequently Asked Questions

What is the IUPAC name of (3R)-3-methoxy-4,4-dimethyloxolan-2-ol?
The IUPAC name of (3R)-3-methoxy-4,4-dimethyloxolan-2-ol (CID 45082816) is (3R)-3-methoxy-4,4-dimethyloxolan-2-ol.
What is the SMILES notation for (3R)-3-methoxy-4,4-dimethyloxolan-2-ol?
The canonical SMILES for (3R)-3-methoxy-4,4-dimethyloxolan-2-ol is CO[C@H]1C(O)OCC1(C)C.
What is the InChIKey of (3R)-3-methoxy-4,4-dimethyloxolan-2-ol?
The InChIKey is VFYJKVIPQITLRZ-ZBHICJROSA-N. The full InChI is InChI=1S/C7H14O3/c1-7(2)4-10-6(8)5(7)9-3/h5-6,8H,4H2,1-3H3/t5-,6?/m0/s1.
What are the key properties of (3R)-3-methoxy-4,4-dimethyloxolan-2-ol?
(3R)-3-methoxy-4,4-dimethyloxolan-2-ol has a molecular weight of 146.19 g/mol, XLogP of 0.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methoxy-4,4-dimethyloxolan-2-ol is sourced from PubChem (CID 45082816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).