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
2.2911 1.0723 -0.0972 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6321 -0.0112 -0.3807 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2261 -0.1430 -0.1096 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4070 -1.3472 -0.4474 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7445 -1.5003 -0.2006 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4504 -0.5062 0.3614 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8492 0.6434 0.6846 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4880 0.8623 0.4588 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8123 1.9106 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3638 1.1770 -0.3024 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2165 -0.8294 -0.8441 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1381 -2.1662 -0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2357 -2.4483 -0.4682 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4271 1.4598 1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0778 1.8265 0.7516 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