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
-2.7385 0.3215 -0.4408 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9051 -0.1531 0.4626 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4644 -0.1446 0.3319 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1951 0.3651 -0.7609 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5926 0.3604 -0.8614 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3597 -0.1668 0.1548 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6726 -0.6714 1.2395 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3353 -0.6576 1.3167 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.8201 0.2899 -0.2914 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3416 0.7480 -1.3432 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3164 -0.5904 1.3882 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3724 0.7921 -1.5884 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0802 0.7719 -1.7403 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4425 -0.1795 0.0955 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2805 -1.0854 2.0373 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