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
2.6837 -0.3339 -0.0323 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6855 0.5202 -0.0662 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2794 0.1330 -0.0139 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6963 1.1070 -0.0559 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0226 0.7408 -0.0066 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4296 -0.5722 0.0843 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4503 -1.4919 0.1228 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.1328 -1.1684 0.0763 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6924 0.0351 -0.0755 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5403 -1.3954 0.0373 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9163 1.5933 -0.1382 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3969 2.1645 -0.1285 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8022 1.4985 -0.0389 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4758 -0.8596 0.1231 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6091 -1.9711 0.1122 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