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
2.6136 -0.5444 -0.1148 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7096 0.3106 -0.5183 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3060 0.0768 -0.3292 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6007 1.0371 -0.7876 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9469 0.8797 -0.6412 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4167 -0.2582 -0.0243 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5665 -1.1801 0.4168 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2178 -1.0280 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3327 -1.4632 0.3786 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6863 -0.3590 -0.2628 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0333 1.2141 -1.0057 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2114 1.9200 -1.2674 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6564 1.6201 -0.9941 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4992 -0.4011 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4341 -1.8244 0.6579 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