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
2.3856 0.8547 0.2529 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6737 -0.1505 -0.2011 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2308 -0.1640 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4984 0.8377 0.4602 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8840 0.7994 0.5445 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5304 -0.2666 0.0547 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8349 -1.2928 -0.5154 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4635 -1.2647 -0.6037 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9558 1.7165 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4792 0.8678 0.1777 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2069 -0.9868 -0.6631 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0114 1.6971 0.8577 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4546 1.6087 0.9957 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3311 -2.1650 -0.9186 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0764 -2.0917 -1.0616 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