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
-1.9109 -0.0072 -0.1976 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5390 -0.3660 0.1974 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5268 0.3646 -0.1036 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9005 -0.0032 0.2971 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8979 0.8817 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4986 0.1924 0.7131 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4387 -0.8132 -0.7537 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3811 -1.2730 0.7642 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4164 1.2981 -0.6802 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8952 -0.7159 1.1711 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4732 -0.4875 -0.5398 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4539 0.9292 0.5430 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