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
2.6345 -0.1872 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6690 0.4262 -0.3266 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2855 0.0864 -0.0682 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7116 0.7994 -0.7591 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0434 0.5373 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3540 -0.4603 0.3317 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4006 -1.1404 0.9908 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0682 -0.9002 0.8217 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4637 -0.9650 0.9777 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6743 0.0950 0.0533 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8985 1.2188 -1.0437 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4465 1.5776 -1.4616 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8338 1.0756 -1.0931 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4156 -0.6799 0.4922 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6480 -1.4833 1.3830 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