Monomers
beta-Butene
Identifiers
IUPAC name
but-2-ene
InchI
InChI=1S/C4H8/c1-3-4-2/h3-4H,1-2H3
InchI Key
IAQRGUVFOMOMEM-UHFFFAOYSA-N
SMILES
CC=CC
Canonical SMILES
CC=CC
Isomeric SMILES
CC=CC
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H8
Heavy Atom Count
4
Molecular Weight
56.108
Exact Molecular Weight
56.0626
Valence Electrons
24
Radical Electrons
0
tPSA
0.0
MolLogP
1.5824
H Bond Acceptors
0
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
12 11 0 0 0 0 0 0 0 0999 V2000
-1.9296 -0.0707 0.0841 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4845 -0.1139 -0.2689 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4882 0.1081 0.5622 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9111 0.0523 0.1584 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0727 0.3094 1.1146 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4375 0.6327 -0.6189 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4069 -1.0668 0.0454 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2187 -0.3492 -1.3019 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2893 0.3448 1.5929 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2513 1.0966 -0.1081 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0781 -0.6451 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5319 -0.2981 1.0123 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 3
3 4 1 0
1 5 1 0
1 6 1 0
1 7 1 0
2 8 1 0
3 9 1 0
4 10 1 0
4 11 1 0
4 12 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers