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
2.4530 -0.6039 0.3431 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6669 0.3081 -0.1373 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2343 0.1633 -0.0812 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4445 -0.8962 0.4566 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8434 -0.9453 0.4638 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5568 0.0606 -0.0643 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.9425 1.1217 -0.6037 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5720 1.1790 -0.6155 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0671 -1.4889 0.7944 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5461 -0.5250 0.3165 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1217 1.1842 -0.5832 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1294 -1.7149 0.8863 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3163 -1.8301 0.9141 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4856 1.9585 -1.0424 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0572 2.0289 -1.0473 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