(2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran

C8H12O — CID 89384318

IUPAC(2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran
SMILESC=C[C@H](C)[C@@H]1CC=CO1
InChIInChI=1S/C8H12O/c1-3-7(2)8-5-4-6-9-8/h3-4,6-8H,1,5H2,2H3/t7-,8-/m0/s1
InChIKeyWYAMQPQVAZLGCC-YUMQZZPRSA-N
MW124.18 g/mol
LogP2.11
Rot. Bonds2

About (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran

(2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran (PubChem CID 89384318) has the molecular formula C8H12O and a molecular weight of 124.18 g/mol. Its IUPAC name is (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran.

Molecular Properties

Compound Name(2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran
PubChem CID89384318
Molecular FormulaC8H12O
Molecular Weight124.18 g/mol
Exact Mass124.09
IUPAC Name(2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran
SMILESC=C[C@H](C)[C@@H]1CC=CO1
InChIInChI=1S/C8H12O/c1-3-7(2)8-5-4-6-9-8/h3-4,6-8H,1,5H2,2H3/t7-,8-/m0/s1
InChIKeyWYAMQPQVAZLGCC-YUMQZZPRSA-N
XLogP2.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.18
LogP ≤ 52.11
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 (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran?
The IUPAC name of (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran (CID 89384318) is (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran.
What is the SMILES notation for (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran?
The canonical SMILES for (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran is C=C[C@H](C)[C@@H]1CC=CO1.
What is the InChIKey of (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran?
The InChIKey is WYAMQPQVAZLGCC-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H12O/c1-3-7(2)8-5-4-6-9-8/h3-4,6-8H,1,5H2,2H3/t7-,8-/m0/s1.
What are the key properties of (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran?
(2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran has a molecular weight of 124.18 g/mol, XLogP of 2.11, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(2S)-but-3-en-2-yl]-2,3-dihydrofuran is sourced from PubChem (CID 89384318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).