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
-1.3741 -0.6115 0.5667 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5583 0.4175 -0.2054 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8469 0.3835 0.2056 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8199 0.1173 -0.6406 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3323 -0.1313 0.8052 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4768 -1.4820 -0.1243 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8254 -0.9813 1.4659 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9709 1.4456 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5986 0.2342 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0721 0.5878 1.2487 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5465 -0.0814 -1.6772 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8510 0.1017 -0.2954 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