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
1.5773 0.2748 -0.1714 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3514 -0.5513 0.2108 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8696 0.2862 0.1793 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8774 -0.0096 -0.6217 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9671 -0.0063 -1.1608 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3747 0.1773 0.6006 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2515 1.3412 -0.2595 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2709 -1.4225 -0.4698 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5326 -0.9510 1.2495 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9493 1.1563 0.8174 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8460 -0.8793 -1.2868 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7831 0.5841 -0.6668 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