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
3.3229 -0.0276 0.6287 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5126 0.0227 -0.3894 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0526 0.0150 -0.3009 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3662 -0.0481 0.8942 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0346 -0.0521 0.9136 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7739 0.0061 -0.2472 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0831 0.0669 -1.3984 N 0 0 0 0 0 0 0 0 0 0 0 0
0.2647 0.0719 -1.4386 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2630 0.0010 -0.2109 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3950 -0.0163 0.4528 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9359 -0.0796 1.6276 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9352 0.0758 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9382 -0.0937 1.8039 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5465 -0.1031 1.8825 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8010 0.1226 -2.3994 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5713 1.0193 0.1195 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5440 -0.6862 0.6278 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7080 -0.2947 -1.1589 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