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
2.5591 -0.3391 0.1076 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6064 0.3787 -0.4311 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1926 0.1672 -0.1544 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7796 0.9639 -0.7581 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1280 0.8218 -0.5444 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5352 -0.1476 0.3010 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.6585 -0.9605 0.9251 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2854 -0.8018 0.6957 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6068 -0.1120 -0.1568 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3503 -1.1530 0.8082 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8783 1.1662 -1.1139 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4369 1.7328 -1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8461 1.4706 -1.0412 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9501 -1.7461 1.6075 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4261 -1.4410 1.1848 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