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
-1.5368 0.1809 -0.3039 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4165 -0.3653 0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8140 0.4051 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8937 -0.1908 -0.2855 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3833 -0.3069 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5275 -0.0070 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3945 1.2701 -0.4458 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2863 -1.4449 0.4449 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6677 -0.1921 1.6629 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7706 1.4784 0.3283 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7423 0.4266 -0.5414 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9919 -1.2540 -0.4406 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