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
2.7423 0.0714 -0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7700 -0.7554 -0.0186 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3495 -0.4004 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0467 0.8667 -0.4353 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3981 1.1412 -0.4652 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3116 0.1674 -0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8365 -1.0801 0.2194 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5330 -1.3764 0.2577 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5212 1.0752 -0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7679 -0.3002 -0.2333 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0427 -1.7698 0.2755 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6415 1.6547 -0.6989 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7362 2.1510 -0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3795 0.3875 -0.1616 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5935 -1.8328 0.4751 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