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
2.5194 0.0735 -0.4388 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4669 -0.7065 -0.4322 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1422 -0.2412 -0.0827 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9193 -1.1324 -0.1007 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1855 -0.7092 0.2284 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4219 0.5685 0.5726 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4227 1.4615 0.6024 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1206 1.0528 0.2702 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4377 1.0994 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4708 -0.3441 -0.7095 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5862 -1.7794 -0.7069 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7074 -2.1515 -0.3796 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9728 -1.4697 0.1914 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5457 2.4992 0.8695 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6727 1.7791 0.2979 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