Monomers
2-Methyl-5-vinylpyridine
Identifiers
IUPAC name
5-ethenyl-2-methylpyridine
InchI
InChI=1S/C8H9N/c1-3-8-5-4-7(2)9-6-8/h3-6H,1H2,2H3
InchI Key
VJOWMORERYNYON-UHFFFAOYSA-N
SMILES
C=Cc1ccc(nc1)C
Canonical SMILES
CC1=NC=C(C=C1)C=C
Isomeric SMILES
CC1=NC=C(C=C1)C=C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H9N
Heavy Atom Count
9
Molecular Weight
119.167
Exact Molecular Weight
119.0735
Valence Electrons
46
Radical Electrons
0
tPSA
12.89
MolLogP
2.033
H Bond Acceptors
1
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
18 18 0 0 0 0 0 0 0 0999 V2000
-2.8887 0.3362 -1.7531 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6144 0.3892 -2.0078 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6000 0.1784 -1.0028 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9046 -0.1009 0.3315 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1481 -0.2821 1.1955 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4520 -0.1978 0.7914 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7220 0.0717 -0.4963 N 0 0 0 0 0 0 0 0 0 0 0 0
0.7310 0.2578 -1.3836 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5653 -0.3984 1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6392 0.4950 -2.5102 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2269 0.1285 -0.7615 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3181 0.6013 -3.0206 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9271 -0.1724 0.6747 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0941 -0.4988 2.2307 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9418 0.4737 -2.4149 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2349 -0.9303 2.6533 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4168 -0.9417 1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0014 0.5905 2.0676 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
6 7 1 0
7 8 2 0
6 9 1 0
8 3 1 0
1 10 1 0
1 11 1 0
2 12 1 0
4 13 1 0
5 14 1 0
8 15 1 0
9 16 1 0
9 17 1 0
9 18 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers