Monomers
2-Vinylpyridine
Identifiers
IUPAC name
2-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-5-3-4-6-8-7/h2-6H,1H2
InchI Key
KGIGUEBEKRSTEW-UHFFFAOYSA-N
SMILES
C=Cc1ccccn1
Canonical SMILES
C=CC1=CC=CC=N1
Isomeric SMILES
C=CC1=CC=CC=N1
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
-2.7705 0.1035 -0.1836 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8058 -0.7844 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3845 -0.4285 -0.1219 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0544 0.8757 -0.1515 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4236 1.1700 -0.1335 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3605 0.1589 -0.0858 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8803 -1.1303 -0.0575 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5600 -1.3861 -0.0756 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.5953 1.1682 -0.2113 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8089 -0.1940 -0.1951 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0942 -1.8470 -0.1136 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6469 1.6965 -0.1891 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7706 2.2029 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4324 0.3351 -0.0702 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6244 -1.9403 -0.0193 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
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers