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
1.4544 0.0304 0.3719 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6280 -0.3600 -0.7864 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6808 -0.2288 -0.7676 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4308 0.3083 0.3856 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1972 -0.8057 0.5216 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0243 0.9674 0.2199 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8019 0.0516 1.2627 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1343 -0.7592 -1.6555 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2627 -0.5260 -1.6384 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5551 -0.5059 1.1164 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4328 0.6757 0.0835 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8779 1.1521 0.8862 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