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
-2.4006 -0.8702 -0.1512 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6811 0.2333 -0.1274 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2316 0.2118 -0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4596 -0.9710 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8444 -0.9291 0.1569 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5440 0.2063 0.1785 N 0 0 0 0 0 0 0 0 0 0 0 0
1.8937 1.3703 0.1018 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5235 1.3794 0.0026 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9968 -1.8496 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4872 -0.8197 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2202 1.1981 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0063 -1.9257 0.0487 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4182 -1.8581 0.2221 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4008 2.3192 0.1142 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0604 2.3050 -0.0632 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