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
2.7431 -0.3403 -0.3199 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8318 0.6115 -0.2158 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4048 0.3747 -0.0483 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1566 -0.8531 0.0205 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5318 -1.0583 0.1819 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3439 0.0437 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7417 1.2820 0.2004 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4154 1.4471 0.0448 N 0 0 0 0 0 0 0 0 0 0 0 0
2.4437 -1.3707 -0.2823 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7910 -0.1468 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2320 1.6275 -0.2652 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4893 -1.7245 -0.0528 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9453 -2.0525 0.2328 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4225 -0.0140 0.4003 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3785 2.1739 0.2725 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