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
-3.2796 0.0695 -0.7411 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5222 0.1051 0.3313 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0733 0.0541 0.2696 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3505 -0.0354 -0.8982 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0419 -0.0813 -0.9028 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7523 -0.0381 0.2765 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0267 0.0492 1.4037 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3096 0.0954 1.4461 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2481 -0.0860 0.2982 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8729 -0.0000 -1.7393 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3727 0.1087 -0.6815 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0042 0.1752 1.2954 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8859 -0.0714 -1.8483 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5869 -0.1517 -1.8345 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8819 0.1662 2.3702 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6371 -0.6125 -0.6033 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6421 0.9405 0.3912 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6175 -0.6874 1.1670 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