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
-1.9041 -0.0788 -0.2582 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5339 -0.1883 0.2868 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5149 0.1848 -0.4188 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9057 0.0855 0.1057 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6085 -0.8132 0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3412 0.9165 -0.1057 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8877 -0.3060 -1.3559 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3983 -0.5801 1.2772 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4084 0.5903 -1.4367 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5740 0.7878 -0.4152 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3120 -0.9392 0.0113 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9588 0.3406 1.1847 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