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
1.7983 0.2193 -0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4224 0.5070 -0.0495 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4362 -0.4732 0.0372 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8037 -0.1932 0.5166 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2295 -0.6242 0.0762 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4874 1.0807 -0.4114 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7513 -0.1319 -1.5954 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1669 1.5156 0.2173 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1554 -1.4666 -0.2347 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2516 -1.1373 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7357 0.5452 1.3318 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4732 0.1585 -0.2942 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