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
2.4874 -0.6213 0.3313 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6119 0.3269 0.5014 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2106 0.2206 0.1354 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6980 1.2388 0.3253 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0081 1.1379 -0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4790 0.0117 -0.5688 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6411 -1.0222 -0.7813 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3077 -0.9339 -0.4382 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5152 -0.4672 0.6296 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2519 -1.5827 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9148 1.2866 0.9485 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3508 2.1644 0.7694 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7407 1.9442 0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0754 -1.9059 -1.2291 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3089 -1.7979 -0.6351 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