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
1.3984 0.6169 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6799 -0.5980 -0.1679 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5852 -0.8376 0.0658 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4504 0.0912 0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7771 1.1462 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2805 0.3795 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7648 1.3185 0.8539 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2586 -1.3128 -0.7399 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0317 -1.7440 -0.3153 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8964 0.5023 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8814 0.8992 0.2108 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3142 -0.4614 1.2636 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