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
1.4053 -0.1533 0.3123 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5826 0.8259 -0.4429 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7178 0.6207 -0.4972 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3324 -0.5579 0.1803 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9337 -0.2572 1.3188 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4322 -1.1159 -0.2304 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4570 0.1865 0.4352 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9995 1.6866 -0.9423 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3163 1.3414 -1.0520 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8300 -0.2570 1.1159 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0534 -0.9899 -0.5484 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5604 -1.3300 0.3507 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