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
1.3631 -0.6580 -0.0407 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7690 0.6991 0.1696 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5272 0.9190 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5184 -0.1374 -0.2157 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9592 -0.9573 0.8502 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0996 -0.5967 -0.8815 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5906 -1.4088 -0.2418 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4780 1.4870 0.3932 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8756 1.9311 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5556 -0.9236 0.5782 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5269 0.2901 -0.2744 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2557 -0.6444 -1.1851 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