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
-2.5885 0.0975 -0.0109 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5488 -0.6953 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1614 -0.2621 -0.0101 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8808 -1.1971 -0.0373 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1944 -0.7787 -0.0153 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4724 0.5438 0.0328 N 0 0 0 0 0 0 0 0 0 0 0 0
1.5289 1.4946 0.0611 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2035 1.0532 0.0383 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4377 1.1612 0.0274 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6016 -0.2729 -0.0295 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7427 -1.7697 -0.0719 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6140 -2.2438 -0.0757 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9753 -1.5355 -0.0377 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7623 2.5551 0.0998 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5511 1.8498 0.0622 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