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
-1.5931 0.1655 -0.2725 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2937 -0.6210 -0.3429 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7844 0.0250 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9256 0.4415 -0.0839 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0138 0.1876 -1.2975 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3438 -0.3727 0.3548 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4727 1.1597 0.1619 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5109 -1.6591 -0.0079 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0430 -0.7334 -1.4144 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6357 0.1664 1.5004 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1439 0.3296 -1.1548 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6953 0.9108 0.5164 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