Monomers
1-Butene
Identifiers
IUPAC name
but-1-ene
InchI
InChI=1S/C4H8/c1-3-4-2/h3H,1,4H2,2H3
InchI Key
VXNZUUAINFGPBY-UHFFFAOYSA-N
SMILES
CCC=C
Canonical SMILES
CCC=C
Isomeric SMILES
CCC=C
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
1.5308 0.3917 -0.0322 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4171 -0.6266 -0.0351 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8450 0.0327 -0.4456 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9244 0.0803 0.3237 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5151 0.8709 0.9837 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3973 1.1934 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5322 -0.0592 -0.1621 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3376 -1.0737 0.9788 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6265 -1.4827 -0.7234 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8836 0.4934 -1.4143 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8261 0.5637 0.0035 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8775 -0.3838 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 3
1 5 1 0
1 6 1 0
1 7 1 0
2 8 1 0
2 9 1 0
3 10 1 0
4 11 1 0
4 12 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers