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
-1.1136 -0.4234 -0.1118 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3484 0.8555 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0624 0.4544 -0.0642 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1233 -0.8490 0.0922 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1374 -1.3789 0.3314 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0157 -0.4952 0.5261 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3056 -0.6680 -1.1743 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6557 1.6634 -0.6087 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5178 1.1759 1.1465 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8943 1.1207 -0.2622 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0142 -1.4553 0.0471 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