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
-1.5836 0.2425 -0.0865 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3162 -0.5863 -0.2104 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8882 0.2370 -0.3793 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8810 0.1767 0.5005 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9766 0.5612 -1.0592 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4405 1.0750 0.6344 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3557 -0.4374 0.3606 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2471 -1.1627 0.7401 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4487 -1.2973 -1.0486 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0074 0.9128 -1.2157 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8053 -0.4865 1.3544 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7864 0.7650 0.4159 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