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
2.4547 -0.7311 0.3957 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6984 0.2495 -0.0311 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2539 0.1747 -0.0601 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4914 -0.9064 0.3457 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8741 -0.9370 0.3014 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5256 0.1461 -0.1625 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.8529 1.2511 -0.5809 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4925 1.2572 -0.5276 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9780 -1.6311 0.7396 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5188 -0.6776 0.4178 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1821 1.1500 -0.3749 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0120 -1.7905 0.7221 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4612 -1.7867 0.6203 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4093 2.1003 -0.9464 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0330 2.1318 -0.8591 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