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
3.2590 0.3996 0.4956 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4527 -0.4675 -0.0817 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0103 -0.3194 -0.0825 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4379 0.7572 0.5355 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9624 0.8391 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7201 -0.1198 -0.1331 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1257 -1.1732 -0.7356 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2263 -1.2853 -0.7186 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2184 -0.0143 -0.1634 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3415 0.2340 0.4631 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9250 1.2792 1.0088 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9087 -1.3306 -0.5772 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9718 1.5435 1.0467 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4651 1.6908 0.9828 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7414 -2.0990 -1.1805 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6707 -0.8841 0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5106 0.9178 0.3626 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6014 0.0320 -1.1961 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