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
-1.5340 0.2266 -0.4975 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4197 -0.0385 0.4875 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8080 -0.5381 -0.1536 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9749 0.0934 -0.0829 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2934 0.8736 -0.0085 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0024 -0.7251 -0.7755 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1770 0.7759 -1.3945 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8179 -0.8158 1.1991 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1762 0.8356 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7702 -1.4647 -0.7128 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8756 -0.2472 -0.5374 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9919 1.0242 0.4845 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