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
-1.8959 -0.1706 0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4653 -0.5172 -0.0363 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4414 0.4093 0.0163 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9088 0.1773 -0.0973 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3031 0.2252 -0.8785 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5153 -1.0874 0.2905 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0565 0.5985 0.8768 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1998 -1.5461 -0.1701 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1617 1.4701 0.1547 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1858 -0.8839 0.1105 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3267 0.5476 -1.0564 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4114 0.7773 0.7015 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