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
1.8491 -0.0393 0.5675 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3996 0.2694 0.6475 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3971 -0.2483 -0.2713 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8802 0.0293 -0.2431 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0008 -0.9899 0.0136 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3211 0.7757 -0.0398 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3127 -0.0948 1.5848 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0052 0.8984 1.4325 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0217 -0.8811 -1.0663 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3101 -0.7415 0.4423 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2634 -0.0372 -1.2701 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0160 1.0593 0.1976 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