Monomers
4-Vinylpyridine
Identifiers
IUPAC name
4-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-3-5-8-6-4-7/h2-6H,1H2
InchI Key
KFDVPJUYSDEJTH-UHFFFAOYSA-N
SMILES
C=Cc1ccncc1
Canonical SMILES
C=CC1=CC=NC=C1
Isomeric SMILES
C=CC1=CC=NC=C1
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
2.4432 0.5138 -0.5643 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5922 -0.4520 -0.3344 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2002 -0.2234 0.0108 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6278 -1.3040 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9368 -1.1100 0.5619 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4925 0.1251 0.6801 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7057 1.1955 0.4644 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3644 1.0179 0.1311 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4897 0.3006 -0.8232 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1705 1.5740 -0.5141 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9654 -1.4771 -0.4105 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2178 -2.2962 0.1512 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6150 -1.9414 0.7463 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1328 2.1866 0.5545 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2315 1.8906 -0.0334 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
7 14 1 0
8 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers