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
-1.3909 -0.5206 -0.4971 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4876 0.5486 0.1004 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7292 -0.1041 0.6269 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9075 0.2324 0.1502 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5419 -0.3301 -1.5704 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3738 -0.5660 -0.0236 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9290 -1.5257 -0.3867 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2636 1.3473 -0.6219 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0807 1.0179 0.9268 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6595 -0.8518 1.3965 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9611 0.9948 -0.6325 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8103 -0.2426 0.5313 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