Monomers
3-Vinylpyridine
Identifiers
IUPAC name
3-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-4-3-5-8-6-7/h2-6H,1H2
InchI Key
DPZYLEIWHTWHCU-UHFFFAOYSA-N
SMILES
C=Cc1cccnc1
Canonical SMILES
C=CC1=CN=CC=C1
Isomeric SMILES
C=CC1=CN=CC=C1
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
-2.4768 0.7432 0.0458 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7653 -0.3500 0.1848 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3154 -0.3578 0.0841 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3993 0.7952 -0.1656 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7902 0.8166 -0.2672 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4375 -0.3874 -0.1046 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7581 -1.5227 0.1395 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4183 -1.5395 0.2367 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0674 1.7171 -0.1513 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5724 0.7122 0.1283 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2732 -1.2813 0.3815 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0654 1.7573 -0.2992 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3436 1.7235 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5326 -0.3836 -0.1823 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1437 -2.4429 0.4325 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
8 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers