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
-2.6716 0.0284 0.2299 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5889 0.7377 0.0198 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2651 0.1836 0.1558 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8482 0.9911 -0.0819 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0973 0.4266 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2865 -0.8894 0.4195 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2034 -1.6373 0.6403 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0443 -1.1235 0.5144 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6515 0.4957 0.1134 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7046 -1.0085 0.5169 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7003 1.7820 -0.2674 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7599 2.0261 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9897 1.0464 -0.1249 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3024 -1.2491 0.5058 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8612 -1.8099 0.7148 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