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
2.4954 0.6317 -0.0618 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6567 -0.3772 -0.0561 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2008 -0.1883 -0.0095 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3970 1.0522 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7865 1.1340 0.0746 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5316 0.0131 0.0751 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.9851 -1.1967 0.0357 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6171 -1.3256 -0.0072 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5495 0.4249 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1498 1.6323 -0.0326 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0078 -1.4145 -0.0862 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2141 1.9436 0.0311 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2270 2.1218 0.1066 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5745 -2.1267 0.0352 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1552 -2.3248 -0.0400 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