Monomers
2-Vinylpyridine
Identifiers
IUPAC name
2-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-5-3-4-6-8-7/h2-6H,1H2
InchI Key
KGIGUEBEKRSTEW-UHFFFAOYSA-N
SMILES
C=Cc1ccccn1
Canonical SMILES
C=CC1=CC=CC=N1
Isomeric SMILES
C=CC1=CC=CC=N1
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
2.6515 0.6606 0.5077 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9076 -0.2618 -0.0679 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4688 -0.1082 -0.0425 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3337 -1.0746 -0.6466 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7010 -0.9755 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2626 0.1360 -0.0221 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4724 1.0913 0.5750 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1264 0.9436 0.5489 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7185 0.5775 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2200 1.5348 1.0021 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3845 -1.0872 -0.5315 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1715 -1.9062 -1.1125 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3298 -1.7133 -1.1119 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3347 0.2565 0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9621 1.9266 1.0438 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
6 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers