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
-1.5158 -0.1105 0.2691 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4143 0.2776 -0.7152 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8241 -0.4535 -0.3658 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9324 0.1801 -0.0464 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7385 0.7009 0.9735 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4685 -0.2974 -0.3009 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2370 -1.0465 0.8079 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2648 1.3688 -0.7537 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7433 -0.0601 -1.7403 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8063 -1.5283 -0.3765 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9567 1.2743 -0.0338 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8627 -0.3054 0.2164 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