Monomers
2,3-Dihydrofuran
Identifiers
IUPAC name
2,3-dihydrofuran
InchI
InChI=1S/C4H6O/c1-2-4-5-3-1/h1,3H,2,4H2
InchI Key
JKTCBAGSMQIFNL-UHFFFAOYSA-N
SMILES
C1CC=CO1
Canonical SMILES
C1COC=C1
Isomeric SMILES
C1COC=C1
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H6O
Heavy Atom Count
5
Molecular Weight
70.091
Exact Molecular Weight
70.0419
Valence Electrons
28
Radical Electrons
0
tPSA
9.23
MolLogP
0.9204
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0
MOL File
RDKit 3D
11 11 0 0 0 0 0 0 0 0999 V2000
-0.9667 0.6875 -0.1597 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5230 -0.7808 -0.1349 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8658 -0.6327 0.3748 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2752 0.5805 0.0421 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2580 1.2545 -0.6543 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1606 0.9884 0.8837 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8061 0.8564 -0.8316 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1614 -1.4008 0.4851 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4318 -1.1357 -1.1934 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3879 -1.4097 0.9103 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2627 0.9925 0.2779 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
4 5 1 0
5 1 1 0
1 6 1 0
1 7 1 0
2 8 1 0
2 9 1 0
3 10 1 0
4 11 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers