Monomers
2-Vinylpyridine
Identifiers
IUPAC name
2-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-5-3-4-6-8-7/h2-6H,1H2
InchI Key
KGIGUEBEKRSTEW-UHFFFAOYSA-N
SMILES
C=Cc1ccccn1
Canonical SMILES
C=CC1=CC=CC=N1
Isomeric SMILES
C=CC1=CC=CC=N1
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H7N
Heavy Atom Count
8
Molecular Weight
105.14
Exact Molecular Weight
105.0578
Valence Electrons
40
Radical Electrons
0
tPSA
12.89
MolLogP
1.7246
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
15 15 0 0 0 0 0 0 0 0999 V2000
2.6896 -0.5472 0.1253 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9149 0.2737 -0.5453 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4614 0.2706 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2337 -0.6112 0.3531 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6098 -0.6361 0.4559 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3120 0.2801 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6236 1.1573 -1.1077 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2978 1.1362 -1.1674 N 0 0 0 0 0 0 0 0 0 0 0 0
2.3403 -1.3083 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7613 -0.4923 0.0143 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3765 0.9924 -1.1996 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3137 -1.3271 0.9453 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1394 -1.3324 1.0944 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4039 0.2824 -0.2397 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2376 1.8620 -1.6862 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
8 3 1 0
1 9 1 0
1 10 1 0
2 11 1 0
4 12 1 0
5 13 1 0
6 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers