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
-1.8443 -0.2267 -0.2796 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4530 -0.4185 0.1792 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4666 0.4572 -0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8591 0.2170 0.2963 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3065 -1.2050 -0.4089 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8935 0.2854 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3567 0.4232 0.4589 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2321 -1.2661 0.8045 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2042 1.2940 -0.8233 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9731 0.8017 1.2342 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5701 0.5090 -0.4759 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0131 -0.8711 0.4861 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