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
2.8019 0.2798 -0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8459 -0.5899 0.0622 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4468 -0.2086 0.0313 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5569 -1.1075 0.2982 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8970 -0.7769 0.2772 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2493 0.5211 -0.0269 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2276 1.4074 -0.2916 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0749 1.0520 -0.2627 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5563 1.3187 -0.4407 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8522 0.0349 -0.1825 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1255 -1.6030 0.2994 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2773 -2.1287 0.5374 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6875 -1.4876 0.4881 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2812 0.8536 -0.0623 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5269 2.4349 -0.5314 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