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
-2.6850 0.4301 -0.2382 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8575 -0.5676 -0.2871 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4198 -0.3689 -0.0989 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1404 0.8612 0.1376 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5202 1.0232 0.3141 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2890 -0.1148 0.2386 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7273 -1.3499 0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4071 -1.4506 -0.1600 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.7608 0.2474 -0.3838 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3551 1.4289 -0.0602 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2481 -1.5751 -0.4731 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4448 1.7483 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9561 1.9998 0.5009 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3628 -0.0562 0.3665 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3682 -2.2555 -0.0556 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