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
2.6200 0.1206 -0.0757 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6385 -0.5740 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2263 -0.3057 0.2404 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2144 0.7144 -0.5596 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5874 0.9461 -0.7503 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5167 0.1435 -0.1299 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0582 -0.8500 0.6495 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7325 -1.0901 0.8464 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6528 -0.1709 0.1594 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4118 0.9545 -0.7286 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9350 -1.4128 1.1174 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4824 1.3527 -1.0534 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8797 1.7603 -1.3884 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5912 0.3069 -0.2651 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3867 -1.8954 1.4779 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