Monomers
1-Hexene
Identifiers
IUPAC name
hex-1-ene
InchI
InChI=1S/C6H12/c1-3-5-6-4-2/h3H,1,4-6H2,2H3
InchI Key
LIKMAJRDDDTEIG-UHFFFAOYSA-N
SMILES
CCCCC=C
Canonical SMILES
CCCCC=C
Isomeric SMILES
CCCCC=C
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H12
Heavy Atom Count
6
Molecular Weight
84.162
Exact Molecular Weight
84.0939
Valence Electrons
36
Radical Electrons
0
tPSA
0.0
MolLogP
2.3626
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
18 17 0 0 0 0 0 0 0 0999 V2000
2.2622 0.0808 -0.9297 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6709 0.0116 0.4631 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2656 -0.5542 0.4387 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6608 0.2945 -0.4049 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0201 -0.2955 -0.3988 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0755 0.3542 0.0486 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0105 1.0670 -1.4197 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0286 -0.7784 -1.5539 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3871 0.1136 -0.8407 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7063 1.0341 0.8777 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2854 -0.7135 1.0464 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3347 -1.5918 0.0679 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1343 -0.5847 1.4715 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2747 0.2195 -1.4601 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6311 1.3513 -0.1346 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1489 -1.2982 -0.7766 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0660 -0.0674 0.0563 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9402 1.3571 0.4253 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 1 0
5 6 2 3
1 7 1 0
1 8 1 0
1 9 1 0
2 10 1 0
2 11 1 0
3 12 1 0
3 13 1 0
4 14 1 0
4 15 1 0
5 16 1 0
6 17 1 0
6 18 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers