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
2.6492 0.0175 0.4354 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6061 0.6604 0.0113 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2436 0.1494 0.0767 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7792 0.9293 -0.4077 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0626 0.4496 -0.3469 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3240 -0.8061 0.1964 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2901 -1.5260 0.6547 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0249 -1.0837 0.6088 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6321 -0.9617 0.8822 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6556 0.4461 0.3636 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7693 1.6598 -0.4267 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6128 1.9129 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9041 1.0234 -0.7143 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3499 -1.1503 0.2271 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7917 -1.7205 1.0020 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