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
-1.5236 -0.4042 0.2501 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3821 0.1164 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7267 0.5753 0.2404 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9249 0.0276 0.1518 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1919 -0.4689 1.3081 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8760 -1.3596 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3530 0.3102 0.1902 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0015 -0.7052 -1.2607 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7346 0.9368 -1.2839 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5262 1.3606 0.9366 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1618 -0.7683 -0.5411 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7202 0.3793 0.7955 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