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
-2.6756 0.9200 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9136 -0.0436 -0.2744 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4627 -0.0435 -0.0863 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2832 -1.0755 -0.6153 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6615 -1.1182 -0.4626 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3004 -0.1109 0.2309 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5208 0.9046 0.7455 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1728 0.9307 0.5867 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.7429 0.9288 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2333 1.7339 0.7617 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3983 -0.8420 -0.8212 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2097 -1.8564 -1.1526 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2690 -1.9137 -0.8661 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3884 -0.1078 0.3738 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0400 1.6934 1.2910 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