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
2.7468 -0.2996 0.1134 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8571 0.4322 -0.5032 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4297 0.2872 -0.2874 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1241 -0.6290 0.5816 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5031 -0.7369 0.7606 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3742 0.0753 0.0698 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7847 0.9789 -0.7897 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4620 1.0784 -0.9578 N 0 0 0 0 0 0 0 0 0 0 0 0
2.4793 -1.0508 0.8152 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8288 -0.1893 -0.0506 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2034 1.1678 -1.1953 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5380 -1.2814 1.1386 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9078 -1.4668 1.4508 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4475 0.0084 0.1936 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4798 1.6255 -1.3395 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