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
2.5346 -0.4262 -0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6268 0.5089 -0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2156 0.2133 -0.0092 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7258 1.2442 -0.0383 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0751 1.0635 -0.0216 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5360 -0.2181 0.0270 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6919 -1.2352 0.0564 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3119 -1.0560 0.0395 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2290 -1.4568 0.0344 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5921 -0.1571 -0.0218 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9395 1.5462 -0.0693 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3140 2.2500 -0.0768 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7698 1.8920 -0.0455 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0583 -2.2356 0.0944 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3452 -1.9332 0.0654 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