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
-1.3693 -0.4060 0.3825 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7091 0.4654 -0.6394 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6008 0.5982 -0.6979 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4527 -0.1341 0.2742 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6991 -0.6221 1.2252 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2760 0.1364 0.7138 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6462 -1.3741 -0.1185 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3273 0.9986 -1.3471 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0236 1.2387 -1.4541 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3240 0.3901 1.2649 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0998 -1.1588 0.4255 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5262 -0.1324 -0.0293 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