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
2.7165 -0.3193 0.3046 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9014 0.4017 -0.4161 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4608 0.2513 -0.2558 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1698 -0.6024 0.6074 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5610 -0.7024 0.7166 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3505 0.0923 -0.0784 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7072 0.9469 -0.9425 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3734 1.0216 -1.0259 N 0 0 0 0 0 0 0 0 0 0 0 0
2.3596 -1.0202 1.0123 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7798 -0.1992 0.1772 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2865 1.1335 -1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4508 -1.2413 1.2466 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0066 -1.3902 1.4117 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4516 0.0474 -0.0264 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3354 1.5804 -1.5763 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