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
-1.5352 -0.0176 -0.3688 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0761 -0.3846 -0.5205 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6751 -0.2349 0.7405 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6864 0.5881 0.7962 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1656 -0.8825 -0.1025 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8846 0.3817 -1.3296 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6273 0.7506 0.4333 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0298 -1.4596 -0.8025 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3624 0.2067 -1.3407 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3840 -0.8045 1.6041 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9726 1.1553 -0.0716 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2382 0.7013 1.7143 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