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
-1.8918 -0.1359 0.1507 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4583 -0.4449 0.2371 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4587 0.3879 -0.2418 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9066 0.1236 -0.1792 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5089 -1.0772 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1202 0.5687 -0.6843 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2602 0.3580 1.0868 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1736 -1.3778 0.7061 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1366 1.3172 -0.7069 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3904 0.7006 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3670 0.5148 -1.1091 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1537 -0.9350 0.0146 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