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
2.5056 -0.0573 0.4978 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5973 -0.5202 -0.3107 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2045 -0.1588 -0.1596 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2929 0.6695 0.8029 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6317 0.9908 0.9144 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4813 0.4572 0.0271 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.0923 -0.3714 -0.9605 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7560 -0.6753 -1.0501 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2321 0.6066 1.2975 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5590 -0.3491 0.3594 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9138 -1.1938 -1.1132 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3766 1.1077 1.5252 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9476 1.6495 1.6981 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7689 -0.8088 -1.6835 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4182 -1.3466 -1.8450 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