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
2.3621 -0.8727 0.5393 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5815 0.2167 -0.1644 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0987 -0.0434 0.0231 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7457 0.9963 -0.6475 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1955 0.6727 -0.4132 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5705 -0.3746 0.2906 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7412 -1.2243 1.3875 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5204 -1.7659 -0.1201 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3632 -0.5001 0.8876 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8823 1.1928 0.2143 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8364 0.1180 -1.2574 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1593 -1.0509 -0.3775 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1091 -0.0679 1.1112 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5425 2.0162 -0.3189 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6180 0.9617 -1.7555 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9701 1.3360 -0.8463 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6220 -0.5655 0.4312 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8533 -1.0452 0.7306 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