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
-1.5545 -0.0971 0.2513 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4238 0.2315 -0.6835 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8221 -0.5011 -0.3404 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9332 0.1556 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5595 0.6349 1.0939 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4721 -1.1000 0.7119 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5000 -0.0464 -0.3481 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2280 1.3365 -0.5896 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6666 0.0642 -1.7423 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8340 -1.5824 -0.3415 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9527 1.2403 -0.0191 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8624 -0.3359 0.2271 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