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
2.7536 0.2188 -0.0239 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8221 -0.5002 0.5547 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4079 -0.2800 0.2728 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0775 0.6591 -0.5878 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4540 0.8073 -0.8037 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3654 0.0057 -0.1507 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8407 -0.9335 0.7125 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5182 -1.0588 0.9048 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7875 0.0207 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5406 1.0007 -0.7288 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1061 -1.2778 1.2601 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6030 1.3008 -1.1136 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8431 1.5513 -1.4858 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4410 0.1009 -0.3011 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4810 -1.6147 1.2757 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