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
-1.5651 -0.1217 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2054 -0.5894 -0.4385 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7414 0.5328 -0.2435 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7872 0.3654 0.5205 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3643 0.4019 1.0272 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9032 0.6585 -0.6472 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2727 -0.9571 0.1797 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2800 -0.8619 -1.5101 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0796 -1.4957 0.1173 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5372 1.4649 -0.7433 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9674 -0.5721 1.0064 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4779 1.1743 0.6666 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