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
-0.9942 -0.6203 0.1923 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5412 0.7497 -0.2514 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9042 0.6555 0.0441 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2313 -0.6189 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0924 -1.3861 -0.3631 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9558 -0.9206 -0.2231 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8921 -0.7115 1.2786 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6363 0.8415 -1.3565 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0530 1.5545 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6028 1.4641 0.2857 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2421 -1.0077 0.1346 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