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
-1.8855 -0.1546 0.1704 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4976 -0.1993 -0.3917 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4953 0.2160 0.3748 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8754 0.1729 -0.1804 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6558 -0.2573 -0.6047 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9657 -1.0117 0.8604 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0509 0.8058 0.6782 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3019 -0.5536 -1.3799 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3267 0.5784 1.3757 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9047 0.4316 -1.2536 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2262 -0.8826 -0.0478 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5289 0.8546 0.3987 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