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
-1.0523 -0.5370 -0.0824 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3933 0.8145 0.2218 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0278 0.5321 -0.0467 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1625 -0.7686 -0.1176 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0047 -1.4743 0.0697 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4916 -0.5503 -1.0866 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7931 -0.7531 0.7042 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7934 1.5855 -0.4649 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5563 1.0908 1.2664 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7793 1.3150 -0.1555 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1153 -1.2546 -0.3084 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