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
1.9050 -0.1821 0.0517 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5322 0.3668 0.1984 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4971 -0.2892 -0.3079 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8907 0.1948 -0.2012 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0845 -0.8103 0.9659 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9472 -0.8424 -0.8639 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6760 0.5747 -0.0877 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3259 1.2982 0.7105 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3104 -1.2143 -0.8188 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5472 -0.5681 0.2633 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2619 0.3646 -1.2364 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9636 1.1072 0.4335 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