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
-0.9707 -0.6594 -0.1568 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4925 0.7778 -0.1657 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8868 0.6259 0.3551 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2627 -0.5994 0.0969 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2508 -1.3069 -0.5616 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2039 -0.9596 0.8741 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7780 -0.8207 -0.8752 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4962 1.0927 -1.2423 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1187 1.4345 0.4661 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4340 1.4333 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2257 -1.0183 0.3544 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