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
-1.5035 -0.3837 -0.2186 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3055 0.5407 -0.4827 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6379 0.2751 0.6179 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8395 -0.1661 0.3429 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3747 -0.1065 -0.8198 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1352 -1.4090 -0.4729 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6828 -0.3932 0.8726 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6506 1.6093 -0.4887 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1454 0.2916 -1.4738 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3309 0.4453 1.6256 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1572 -0.3405 -0.6731 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5414 -0.3631 1.1708 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