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
2.5146 -0.3891 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5916 0.4945 -0.3111 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1949 0.2098 -0.0915 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2497 -0.9962 0.3773 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6281 -1.1723 0.5566 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5270 -0.2124 0.2892 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.0987 0.9757 -0.1719 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7719 1.1929 -0.3615 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3174 -1.3615 0.2914 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5749 -0.1583 -0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8659 1.4935 -0.6916 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4333 -1.8007 0.6073 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9265 -2.1421 0.9285 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8696 1.7226 -0.3739 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4211 2.1435 -0.7310 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