Monomers
3-Vinylpyridine
Identifiers
IUPAC name
3-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-4-3-5-8-6-7/h2-6H,1H2
InchI Key
DPZYLEIWHTWHCU-UHFFFAOYSA-N
SMILES
C=Cc1cccnc1
Canonical SMILES
C=CC1=CN=CC=C1
Isomeric SMILES
C=CC1=CN=CC=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
2.4970 0.7276 0.3157 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7269 -0.3334 0.2395 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3152 -0.3149 -0.0252 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3974 0.8400 -0.2319 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7607 0.8060 -0.4843 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4361 -0.3820 -0.5345 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7386 -1.5176 -0.3318 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4033 -1.4868 -0.0845 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5413 0.6306 0.5168 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0822 1.6969 0.1765 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1870 -1.3315 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1115 1.7855 -0.1972 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3237 1.7218 -0.6478 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4952 -0.4157 -0.7301 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0940 -2.4264 0.0683 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
8 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers