(2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran

C8H14O — CID 58208616

IUPAC(2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran
SMILESCC[C@H](C)[C@@H]1C=CCO1
InChIInChI=1S/C8H14O/c1-3-7(2)8-5-4-6-9-8/h4-5,7-8H,3,6H2,1-2H3/t7-,8-/m0/s1
InChIKeyAWESOFKZTSLPRO-YUMQZZPRSA-N
MW126.20 g/mol
LogP1.99
Rot. Bonds2

About (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran

(2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran (PubChem CID 58208616) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran.

Molecular Properties

Compound Name(2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran
PubChem CID58208616
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name(2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran
SMILESCC[C@H](C)[C@@H]1C=CCO1
InChIInChI=1S/C8H14O/c1-3-7(2)8-5-4-6-9-8/h4-5,7-8H,3,6H2,1-2H3/t7-,8-/m0/s1
InChIKeyAWESOFKZTSLPRO-YUMQZZPRSA-N
XLogP1.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran?
The IUPAC name of (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran (CID 58208616) is (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran.
What is the SMILES notation for (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran?
The canonical SMILES for (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran is CC[C@H](C)[C@@H]1C=CCO1.
What is the InChIKey of (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran?
The InChIKey is AWESOFKZTSLPRO-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H14O/c1-3-7(2)8-5-4-6-9-8/h4-5,7-8H,3,6H2,1-2H3/t7-,8-/m0/s1.
What are the key properties of (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran?
(2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran has a molecular weight of 126.20 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(2S)-butan-2-yl]-2,5-dihydrofuran is sourced from PubChem (CID 58208616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).