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
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
2.6631 -0.8946 -0.1161 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9369 0.2032 -0.0503 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4866 0.1188 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3060 1.2465 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6871 1.1695 0.0976 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3280 -0.0532 0.0681 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4960 -1.1539 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1537 -1.0656 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0
3.7428 -0.8375 -0.1463 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2243 -1.8764 -0.1421 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4062 1.1648 -0.0259 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1872 2.2112 0.0826 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3204 2.0549 0.1521 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4077 -0.1456 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9484 -2.1420 -0.0268 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