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
2.7919 -0.0453 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7690 -0.7318 0.3375 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4144 -0.2395 0.1204 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6793 -0.9283 0.6058 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9657 -0.4573 0.3975 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1883 0.7115 -0.2997 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0708 1.3701 -0.7681 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1686 0.8950 -0.5545 N 0 0 0 0 0 0 0 0 0 0 0 0
3.8168 -0.3535 -0.0169 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6413 0.8815 -0.6964 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9794 -1.6400 0.8769 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4822 -1.8391 1.1477 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8059 -1.0166 0.7887 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1946 1.1047 -0.4777 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1945 2.2886 -1.3192 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