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
-2.7540 -0.1187 -0.3349 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7840 -0.8028 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4173 -0.2589 0.2654 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6154 -0.9881 0.8161 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8936 -0.4531 0.8828 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1686 0.8197 0.4019 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0980 1.5062 -0.1393 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1360 0.9703 -0.1954 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.7470 -0.5195 -0.3931 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5755 0.8683 -0.7158 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9512 -1.7963 0.5683 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4110 -1.9934 1.1989 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7201 -0.9912 1.3041 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1576 1.2469 0.4478 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3008 2.5105 -0.5221 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