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
3.3766 0.7055 0.1831 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4967 -0.2705 0.2326 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0583 -0.1272 0.0978 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2142 -1.2402 0.1671 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1525 -1.1095 0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7532 0.1148 -0.1609 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9373 1.1799 -0.2266 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4206 1.0760 -0.1033 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2248 0.2026 -0.2915 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0165 1.7104 0.0291 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4447 0.5407 0.2904 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8854 -1.2711 0.3883 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6928 -2.2027 0.3254 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7969 -1.9851 0.0959 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0449 1.9682 -0.1631 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5402 0.3006 -1.3484 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6644 -0.6871 0.1697 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5813 1.0947 0.2747 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