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
-2.6839 0.4417 0.3012 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9071 -0.2384 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4605 -0.2063 -0.3023 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1980 0.5144 0.6641 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5817 0.5270 0.8104 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3209 -0.2327 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6631 -0.9634 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3327 -0.9431 -1.1520 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.3011 1.0438 1.0928 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7717 0.4381 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3550 -0.8314 -1.2654 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3725 1.1136 1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0612 1.1094 1.5863 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3991 -0.2337 0.0275 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2950 -1.5391 -1.7146 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