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
2.4944 0.6204 0.3813 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7114 -0.4197 0.2145 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2888 -0.3335 0.0487 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3807 0.8669 0.0511 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7397 0.8902 -0.1113 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4249 -0.2839 -0.2754 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7780 -1.4621 -0.2789 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4450 -1.5145 -0.1217 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5727 0.5311 0.5052 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1364 1.6409 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1923 -1.3921 0.2049 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1332 1.8041 0.1781 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3194 1.8104 -0.1175 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5165 -0.2746 -0.4065 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0748 -2.4836 -0.1261 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