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
2.5835 -0.4637 0.3285 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7282 0.5119 0.2119 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2848 0.3406 0.0869 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3398 -0.8859 0.0783 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7285 -0.9739 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4984 0.1525 -0.1598 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8831 1.3457 -0.1508 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.5481 1.4502 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6444 -0.2960 0.4188 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2353 -1.4828 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1368 1.5319 0.2089 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2465 -1.7899 0.1676 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2139 -1.9377 -0.0512 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5809 0.0645 -0.2551 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0668 2.4325 -0.0279 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