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
2.5342 -0.4848 -0.1128 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6031 0.4003 -0.3189 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1978 0.2074 -0.0947 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7021 1.2253 -0.3508 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0459 1.0494 -0.1394 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5381 -0.1125 0.3224 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.7109 -1.1368 0.5889 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3481 -0.9733 0.3797 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2855 -1.4667 0.2587 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5879 -0.3030 -0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9308 1.3774 -0.6976 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3544 2.1997 -0.7308 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7118 1.9001 -0.3630 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0453 -2.0949 0.9617 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3173 -1.7874 0.5905 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