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
-2.4849 0.4009 0.4148 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5859 -0.5248 0.1758 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1824 -0.2256 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7426 -1.2567 -0.2535 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0829 -1.0263 -0.4264 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5097 0.2488 -0.3445 N 0 0 0 0 0 0 0 0 0 0 0 0
1.6614 1.2601 -0.1032 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2904 1.0542 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5554 0.1299 0.5429 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2854 1.4604 0.5059 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9381 -1.5516 0.1111 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3745 -2.2748 -0.3148 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7487 -1.8634 -0.6207 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9987 2.2983 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3769 1.8705 0.2692 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