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
2.5013 0.6595 0.2881 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7356 -0.1046 -0.4633 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3133 -0.1857 -0.2804 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3549 0.5254 0.6892 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7289 0.3936 0.8029 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4641 -0.4283 -0.0226 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7745 -1.1054 -0.9564 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4516 -1.0035 -1.0953 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5797 0.6923 0.1156 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1305 1.2670 1.0773 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1773 -0.7162 -1.2713 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1609 1.1888 1.3707 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2720 0.9411 1.5551 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5555 -0.5257 0.0763 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0028 -1.5983 -1.8859 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