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
-1.8950 0.0705 0.2672 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4718 0.4652 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4526 -0.4543 -0.1083 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8740 -0.0441 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0784 -0.7689 -0.4498 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0225 -0.3379 1.2897 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5786 0.9161 0.0587 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2334 1.5169 0.1404 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2250 -1.5105 -0.1565 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5572 -0.8871 -0.0984 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1406 0.7756 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0304 0.2586 -1.3559 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