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
-1.5918 -0.0380 -0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2866 0.0596 0.6286 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8544 -0.4786 -0.1048 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8793 0.3055 -0.3805 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4337 0.1052 0.5332 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7094 -1.0749 -0.5799 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6620 0.7379 -0.9342 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1574 1.1177 0.8678 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4078 -0.5148 1.5651 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8783 -1.5044 -0.4269 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9062 1.3517 -0.0777 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7306 -0.0669 -0.9189 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