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
-1.6018 -0.0615 0.1017 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2227 -0.6319 -0.1383 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7831 0.3823 -0.4733 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8422 0.5482 0.2799 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3103 -0.9210 0.0663 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8779 0.7156 -0.6284 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6196 0.3024 1.1462 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2510 -1.3794 -0.9723 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0512 -1.1881 0.7889 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6478 0.9974 -1.3497 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9884 -0.0582 1.1554 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5707 1.2941 0.0235 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