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
-0.9607 -0.6842 -0.0361 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5765 0.7553 -0.1014 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8720 0.6728 0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2781 -0.5496 -0.0829 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2143 -1.3053 -0.5815 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9655 -0.9832 1.0381 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8633 -0.9521 -0.5795 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1356 1.3989 0.6081 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6557 1.1913 -1.1154 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5248 1.4323 0.6191 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2680 -0.9763 0.0144 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