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
2.0794 -1.2967 -0.2096 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0313 -0.3083 0.3024 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3446 0.3892 -0.8413 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7005 1.3533 -0.4369 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8783 0.8397 0.2565 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2318 -0.4150 0.4525 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0493 -0.8129 -0.3566 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2024 -2.1118 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7085 -1.6961 -1.1686 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3157 -0.7555 0.9646 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6336 0.4201 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0342 -0.3829 -1.5693 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1529 0.9113 -1.4312 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2245 2.1141 0.2595 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0180 2.0064 -1.3037 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5364 1.6517 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1671 -0.6087 1.0078 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7269 -1.2979 0.1205 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