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
-0.9224 0.6607 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6079 -0.7439 -0.1815 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8923 -0.6934 -0.1191 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2306 0.5828 -0.2131 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1013 1.3827 -0.3316 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6975 0.6895 1.4005 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9321 0.9890 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0137 -1.4849 0.5139 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8802 -0.8828 -1.2311 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5864 -1.5010 -0.0193 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2432 1.0012 -0.2039 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