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
-2.4280 0.7378 0.2012 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6881 -0.3259 -0.0284 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2417 -0.1893 -0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5413 -1.3161 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9160 -1.2773 -0.2983 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5386 -0.1122 -0.0781 N 0 0 0 0 0 0 0 0 0 0 0 0
1.8501 1.0320 0.1667 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4517 0.9625 0.1833 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0756 1.7315 0.3929 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5227 0.6208 0.2017 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1250 -1.2983 -0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0312 -2.2616 -0.4547 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5087 -2.1562 -0.4878 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3277 1.9815 0.3468 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0842 1.8707 0.3774 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