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
-1.8703 0.2012 -0.3296 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3902 0.2153 -0.4716 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3796 -0.2311 0.4860 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8649 -0.2107 0.3295 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2610 -0.4951 -1.0922 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1654 -0.1072 0.7092 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2207 1.2434 -0.4736 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0048 0.6170 -1.4131 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0772 -0.6135 1.3891 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1123 0.5388 -0.4471 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2600 -1.1950 0.0144 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3728 0.0369 1.2990 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