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
2.5258 -0.2724 -0.0423 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5540 0.4355 0.4817 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1672 0.1923 0.1743 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2269 -0.7974 -0.6878 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5776 -1.0298 -0.9835 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4654 -0.2379 -0.3827 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.1318 0.7393 0.4644 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8137 0.9779 0.7628 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3604 -1.0798 -0.7343 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5700 -0.0524 0.2202 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7992 1.2405 1.1774 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4743 -1.4399 -1.1767 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8484 -1.8197 -1.6684 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8828 1.3712 0.9406 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5045 1.7724 1.4544 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