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
1.4152 -0.1701 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4984 0.3003 0.9046 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8010 0.3096 0.7006 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3104 -0.1605 -0.6122 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2868 -0.6457 0.3046 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8922 -0.8117 -0.8902 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7834 0.7156 -0.7569 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9413 0.6280 1.8351 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4866 0.6584 1.4882 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7136 0.3301 -1.4184 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3792 0.0976 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1266 -1.2516 -0.7243 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