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
2.4749 -0.6419 -0.0165 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6456 0.2960 -0.3549 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2284 0.1798 -0.1153 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6392 1.2129 -0.4939 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9972 1.1738 -0.2986 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5213 0.0843 0.2879 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7518 -0.9465 0.6782 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3651 -0.9066 0.4788 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1384 -1.5432 0.4562 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5554 -0.5924 -0.1806 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0288 1.1858 -0.8282 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1851 2.0687 -0.9601 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6332 2.0160 -0.6165 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1884 -1.8270 1.1538 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2096 -1.7596 0.8098 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