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
-1.3988 -0.3806 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5525 0.5349 0.7443 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7377 0.6460 0.5275 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3343 -0.1851 -0.5522 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4583 -1.3942 0.3942 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9783 -0.5438 -1.0843 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3843 0.1045 -0.1771 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0166 1.1217 1.5179 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3376 1.3217 1.1195 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9030 0.1626 -1.5157 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4380 -0.1355 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0382 -1.2523 -0.3681 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