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
-1.2059 0.4998 0.1252 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4914 -0.8366 -0.0978 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9654 -0.6307 -0.0082 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4802 0.5510 0.2294 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8980 1.2409 -0.6259 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3051 0.3535 0.1215 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9199 0.8546 1.1571 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8514 -1.5085 0.6926 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8242 -1.2162 -1.0704 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6305 -1.4704 -0.1405 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5521 0.7160 0.2979 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8678 1.4466 0.3740 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