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
1.0019 0.8045 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6939 -0.5393 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7624 -0.8655 -0.6853 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5554 0.0140 -0.1216 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7878 0.8911 0.8771 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0917 0.9751 -0.3163 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4983 1.6278 -0.7246 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2627 -1.3572 -0.3401 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9132 -0.4567 -1.8814 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1538 -1.8128 -1.0748 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6250 -0.2254 -0.0505 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1528 0.9444 0.2576 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