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
2.4523 -0.7250 0.2519 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6464 0.1071 -0.3651 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2008 0.1391 -0.1579 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5531 1.0523 -0.8564 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9120 1.0844 -0.6635 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5111 0.2458 0.1888 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8134 -0.6462 0.8775 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4382 -0.7088 0.7093 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5065 -0.6857 0.0444 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1096 -1.4554 0.9648 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1168 0.8065 -1.0711 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1285 1.7592 -1.5618 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5188 1.8082 -1.2156 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2709 -1.3466 1.5823 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1136 -1.4349 1.2725 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