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
-0.9912 0.6666 -0.0275 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5183 -0.7609 -0.1582 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9010 -0.6501 0.2283 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2671 0.5952 0.0125 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1871 1.3476 -0.4973 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8317 0.8840 -0.6868 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1697 0.8927 1.0423 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5697 -1.0527 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0881 -1.4542 0.4902 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5433 -1.4564 0.6253 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2701 0.9882 0.2032 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