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
0.7093 1.3132 -0.4516 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7549 -0.1942 -0.1565 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4681 -0.4641 0.6585 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4120 -1.2990 0.2779 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6686 1.8597 0.5116 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1868 1.5754 -1.0301 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5879 1.5721 -1.0657 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7988 -0.7745 -1.0738 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6177 -0.4137 0.5016 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5361 0.0795 1.6041 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2648 -1.4514 0.9039 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2693 -1.8029 -0.6799 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