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
2.4447 -0.8836 0.1186 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7834 0.2029 -0.1488 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3523 0.2745 -0.0945 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4539 -0.7848 0.2415 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8396 -0.6348 0.2717 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4492 0.5594 -0.0284 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6385 1.5793 -0.3536 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3073 1.4759 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5404 -0.9017 0.0669 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9343 -1.7824 0.3946 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3518 1.1015 -0.4276 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0271 -1.7553 0.4889 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4441 -1.4887 0.5401 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5352 0.6856 -0.0071 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2882 2.3521 -0.6681 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