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
2.5724 0.1560 -0.0594 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5531 -0.6745 0.0609 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1786 -0.2440 0.0857 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2012 1.0776 -0.0142 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5596 1.4096 0.0185 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5081 0.4640 0.1458 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.1762 -0.8356 0.2459 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8388 -1.1673 0.2141 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5939 -0.1885 -0.0756 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4490 1.2364 -0.1496 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7819 -1.7304 0.1442 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5141 1.8504 -0.1155 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8123 2.4604 -0.0631 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9498 -1.5974 0.3488 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5971 -2.2167 0.2961 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