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
-1.5287 0.2901 -0.3999 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4130 -0.6301 0.1136 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7410 0.2275 0.4947 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9187 0.0713 -0.1011 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5693 1.1292 0.3298 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5021 -0.2176 -0.3818 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2253 0.6650 -1.3753 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1451 -1.3167 -0.6946 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7667 -1.2244 0.9795 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6313 0.9859 1.2603 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7699 0.6887 0.1655 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0892 -0.6689 -0.8723 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