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
-0.8636 0.7776 -0.2206 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6208 -0.6945 0.0262 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8076 -0.6976 0.3966 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3429 0.3767 -0.1472 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3820 1.1065 -0.8574 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8930 1.2628 0.7828 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7245 0.9894 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8299 -1.2258 -0.9218 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2762 -1.0805 0.8347 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2900 -1.4599 1.0049 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3855 0.6453 -0.0494 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