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
2.5196 -0.4588 -0.2363 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6297 0.4420 0.1168 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2014 0.2282 0.0778 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6817 1.2428 0.4722 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0334 1.0073 0.4232 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5482 -0.1612 0.0108 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7296 -1.1509 -0.3728 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3590 -0.9562 -0.3392 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2248 -1.4324 -0.5835 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5858 -0.2821 -0.2009 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0162 1.3982 0.4552 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2693 2.1940 0.8081 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6725 1.8412 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1405 -2.1155 -0.7136 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2566 -1.7967 -0.6627 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