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
-2.4141 0.7980 -0.2301 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5197 -0.2346 0.4258 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0945 0.0262 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8885 -0.9252 0.5823 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2338 -0.5761 0.1103 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4142 0.4436 -0.6841 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1645 1.2019 0.4923 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9730 0.3636 -1.0940 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8291 1.6700 -0.5836 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6565 -0.2922 1.4991 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7920 -1.2398 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0124 -0.0370 -1.1105 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1534 1.0524 0.3112 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9021 -0.9286 1.6951 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7133 -1.9816 0.2762 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0768 -1.1605 0.4183 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4264 0.7107 -1.0427 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6471 1.1089 -1.0630 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