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
-1.9190 -0.0758 -0.2433 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4906 -0.4260 -0.0084 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4898 0.4155 -0.2382 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8996 0.0524 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4933 -0.8990 -0.7031 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9501 0.7666 -0.9691 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3406 0.2891 0.7067 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3219 -1.4490 0.3739 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2367 1.4002 -0.6132 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1412 -0.0512 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5810 0.8482 -0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1673 -0.8711 -0.5732 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