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
-2.4930 -0.5869 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7326 0.3748 -0.3511 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2939 0.2981 -0.1814 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3748 -0.7328 0.4145 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7490 -0.7935 0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4689 0.2751 0.0798 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8207 1.3186 -0.5207 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4916 1.3564 -0.6603 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1754 -1.4836 0.5745 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5776 -0.5078 -0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1696 1.2277 -0.8335 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2007 -1.5619 0.7933 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2262 -1.6310 1.0481 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5301 0.2563 0.1853 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0187 2.1905 -1.1396 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