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
-1.8782 -0.2645 -0.3147 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4529 -0.5150 -0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4547 0.4193 -0.2043 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8985 0.2443 0.0768 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0067 0.6324 -0.9792 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3242 -1.1111 -0.8994 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4723 -0.0569 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1506 -1.4679 0.3752 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1471 1.3828 -0.5937 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4418 0.6596 -0.8166 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1330 0.8621 0.9841 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2098 -0.7851 0.2354 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