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
2.6964 0.0993 -0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6553 -0.4067 0.6048 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2900 -0.0979 0.2547 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7644 -0.6734 0.9499 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0784 -0.3986 0.6396 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3939 0.4681 -0.3848 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3706 1.0234 -1.0558 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0692 0.7628 -0.7622 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7069 -0.1675 0.2969 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6370 0.7861 -0.8215 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8284 -1.1074 1.4338 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5269 -1.3524 1.7526 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9077 -0.8590 1.1957 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4327 0.6885 -0.6339 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7299 1.2347 -1.3315 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