(2R)-2-methoxybutane

C5H12O — CID 642401

IUPAC(2R)-2-methoxybutane
SMILESCC[C@@H](C)OC
InChIInChI=1S/C5H12O/c1-4-5(2)6-3/h5H,4H2,1-3H3/t5-/m1/s1
InChIKeyFVNIMHIOIXPIQT-RXMQYKEDSA-N
MW88.15 g/mol
LogP1.43
Rot. Bonds2

About (2R)-2-methoxybutane

(2R)-2-methoxybutane (PubChem CID 642401) has the molecular formula C5H12O and a molecular weight of 88.15 g/mol. Its IUPAC name is (2R)-2-methoxybutane.

Molecular Properties

Compound Name(2R)-2-methoxybutane
PubChem CID642401
Molecular FormulaC5H12O
Molecular Weight88.15 g/mol
Exact Mass88.09
IUPAC Name(2R)-2-methoxybutane
SMILESCC[C@@H](C)OC
InChIInChI=1S/C5H12O/c1-4-5(2)6-3/h5H,4H2,1-3H3/t5-/m1/s1
InChIKeyFVNIMHIOIXPIQT-RXMQYKEDSA-N
XLogP1.43
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.15
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-methoxybutane?
The IUPAC name of (2R)-2-methoxybutane (CID 642401) is (2R)-2-methoxybutane.
What is the SMILES notation for (2R)-2-methoxybutane?
The canonical SMILES for (2R)-2-methoxybutane is CC[C@@H](C)OC.
What is the InChIKey of (2R)-2-methoxybutane?
The InChIKey is FVNIMHIOIXPIQT-RXMQYKEDSA-N. The full InChI is InChI=1S/C5H12O/c1-4-5(2)6-3/h5H,4H2,1-3H3/t5-/m1/s1.
What are the key properties of (2R)-2-methoxybutane?
(2R)-2-methoxybutane has a molecular weight of 88.15 g/mol, XLogP of 1.43, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methoxybutane is sourced from PubChem (CID 642401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).