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
-2.6840 -0.2627 -0.0762 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6803 0.5665 0.1086 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2840 0.1505 0.0301 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7177 1.0894 0.2385 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0163 0.6707 0.1586 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3934 -0.6296 -0.1168 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4097 -1.5233 -0.3154 N 0 0 0 0 0 0 0 0 0 0 0 0
0.1150 -1.1389 -0.2429 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5362 -1.3084 -0.2988 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7060 0.1173 -0.0026 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9079 1.5945 0.3268 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4777 2.1326 0.4599 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8420 1.3776 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4488 -0.9255 -0.1723 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6222 -1.9107 -0.4135 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