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
2.6490 0.5388 -0.1934 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6136 -0.0677 -0.7394 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2810 -0.0322 -0.1608 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7611 -0.6946 -0.7922 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0375 -0.6780 -0.2652 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3340 -0.0085 0.9025 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3152 0.6266 1.5001 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0427 0.6258 0.9995 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6249 0.4886 -0.6551 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5749 1.1015 0.7192 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7660 -0.6269 -1.6773 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5519 -1.2324 -1.7188 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8667 -1.1961 -0.7536 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3468 -0.0085 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7465 1.1637 1.5345 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