Monomers
4-Vinylpyridine
Identifiers
IUPAC name
4-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-3-5-8-6-4-7/h2-6H,1H2
InchI Key
KFDVPJUYSDEJTH-UHFFFAOYSA-N
SMILES
C=Cc1ccncc1
Canonical SMILES
C=CC1=CC=NC=C1
Isomeric SMILES
C=CC1=CC=NC=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
-2.4773 -0.6872 0.1575 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6609 0.3113 -0.1083 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2135 0.1984 -0.0578 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5639 1.2987 -0.3524 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9481 1.2477 -0.3198 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5085 0.0733 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0
1.8259 -1.0428 0.3132 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4277 -0.9680 0.2739 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5479 -0.5700 0.1108 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0691 -1.6401 0.4269 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1217 1.2832 -0.3838 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0660 2.2214 -0.6147 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5412 2.1196 -0.5535 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3064 -1.9808 0.5795 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0973 -1.8647 0.5154 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
7 14 1 0
8 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers