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
-2.4865 -0.5214 0.4949 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7600 0.1245 -0.3865 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3151 0.1567 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3775 -0.4664 0.7395 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7691 -0.3603 0.7398 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4714 0.3339 -0.2167 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7721 0.9337 -1.1922 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4327 0.8499 -1.2198 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1051 -1.0547 1.3348 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5764 -0.5114 0.3557 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2157 0.6546 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1362 -1.0245 1.5144 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2963 -0.8548 1.5384 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5652 0.3894 -0.1749 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0893 1.3508 -2.0273 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