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
1.8921 -0.0371 -0.2104 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4878 -0.4815 -0.0754 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4687 0.3893 0.0701 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9112 0.0481 0.2139 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4607 -0.6029 -0.9587 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3714 -0.1589 0.7886 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9651 1.0339 -0.4706 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2469 -1.5391 -0.0971 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2375 1.4458 0.0928 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2677 0.1084 1.2463 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0452 -0.9795 -0.2091 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4940 0.7734 -0.3905 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