Monomers
4-Vinylpyridine
Identifiers
IUPAC name
4-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-3-5-8-6-4-7/h2-6H,1H2
InchI Key
KFDVPJUYSDEJTH-UHFFFAOYSA-N
SMILES
C=Cc1ccncc1
Canonical SMILES
C=CC1=CC=NC=C1
Isomeric SMILES
C=CC1=CC=NC=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
2.5881 0.2601 0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6037 -0.5901 -0.0473 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1928 -0.2311 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2792 1.0482 0.1989 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6360 1.3545 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5405 0.3915 -0.0347 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.1379 -0.8800 -0.2731 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7780 -1.1822 -0.2732 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3810 1.2984 0.3684 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5992 -0.1203 0.1368 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8336 -1.6353 -0.2478 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4460 1.8161 0.3862 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9843 2.3591 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8454 -1.6875 -0.4677 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4431 -2.2017 -0.4639 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
7 14 1 0
8 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers