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
-1.3859 0.3202 0.6464 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4395 0.2885 -0.5583 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6241 -0.6708 -0.2147 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8704 -0.2736 -0.1687 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8507 1.3082 0.6685 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8000 0.1501 1.5887 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1248 -0.5071 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0403 -0.0762 -1.4412 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0670 1.2985 -0.8028 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3491 -1.6803 -0.0088 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1493 0.7647 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7155 -0.9222 0.0777 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