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
-1.4893 -0.1952 0.8126 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4796 0.3081 -0.2057 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8090 -0.3737 -0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9391 0.2656 0.2751 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4846 0.0347 0.4188 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3420 -1.3031 0.9007 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3131 0.2894 1.8057 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8753 -0.0268 -1.2086 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4302 1.3980 -0.1773 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8237 -1.4546 -0.1097 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8634 -0.2804 0.4092 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9788 1.3381 0.3836 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