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
1.9063 0.1088 -0.3762 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5419 0.1499 0.1932 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5336 -0.1649 -0.5305 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9030 -0.1219 0.0466 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5981 0.8232 0.1122 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8137 0.4629 -1.4405 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2583 -0.9386 -0.3264 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3946 0.4422 1.2263 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3954 -0.4642 -1.5849 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8589 0.4536 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2706 -1.1344 0.3293 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5515 0.3835 -0.6935 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