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
-1.9010 -0.0917 0.0409 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4738 -0.4238 0.2537 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4838 0.3601 -0.2093 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9284 0.0831 -0.0295 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4103 0.1948 0.9857 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0000 0.7547 -0.6622 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4649 -0.9341 -0.4058 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1889 -1.3115 0.7903 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2073 1.2574 -0.7517 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4246 1.0555 0.1711 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0917 -0.6124 0.8135 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3032 -0.3321 -0.9968 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