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
-2.5629 -0.8520 0.6933 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9699 -0.0176 -0.1302 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5254 0.1588 -0.2047 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3761 -0.5291 0.5785 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7522 -0.3406 0.4861 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2640 0.5636 -0.4157 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3468 1.2414 -1.1896 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0212 1.0445 -1.0847 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.6366 -0.9763 0.7417 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9955 -1.4661 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5819 0.5759 -0.7937 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0012 -1.2533 1.3033 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4463 -0.8864 1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3125 0.7738 -0.5553 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7543 1.9637 -1.9101 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