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
-1.4802 -0.4069 0.1105 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6623 0.7395 0.5789 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6581 0.7655 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4911 -0.3401 0.0152 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7941 -1.0466 0.9729 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4181 -0.0141 -0.3338 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9120 -0.9612 -0.6417 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2011 1.5902 0.9747 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1683 1.6474 0.9005 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5338 -0.0306 -0.1251 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0936 -0.7554 -0.9337 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5230 -1.1877 0.7490 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