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
-2.7936 -0.3129 0.0915 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8605 0.5301 -0.2981 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4354 0.1941 -0.1038 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5627 1.0517 -0.4991 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8966 0.7191 -0.3084 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2318 -0.4825 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2133 -1.3182 0.6672 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0818 -0.9685 0.4691 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.4841 -1.2407 0.5493 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8210 -0.0355 -0.0657 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1047 1.4587 -0.7549 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2590 1.9809 -0.9574 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6661 1.4032 -0.6243 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2872 -0.7206 0.4216 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4644 -2.2589 1.1300 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