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
2.4118 -0.7781 -0.0265 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6634 0.2843 -0.1467 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2267 0.2103 -0.0468 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4045 -0.9808 0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8029 -0.9969 0.2665 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5148 0.1259 0.1348 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.9260 1.3133 -0.0868 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5728 1.3370 -0.1736 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5047 -0.6221 -0.1181 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0534 -1.7706 0.1506 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1103 1.2828 -0.3302 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1181 -1.9333 0.2946 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2535 -1.9611 0.4447 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5458 2.2168 -0.1898 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0683 2.2724 -0.3507 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