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
-2.7289 -0.0203 0.4411 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8067 0.7566 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4054 0.3703 -0.1017 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1091 -0.8162 0.3486 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4737 -1.1261 0.2714 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -0.1949 -0.2784 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7838 1.0092 -0.7347 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4703 1.2677 -0.6426 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.4751 -0.9822 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7520 0.3001 0.4595 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1377 1.7331 -0.4382 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5644 -1.5428 0.7809 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8549 -2.0624 0.6307 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3751 -0.3993 -0.3554 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4934 1.7071 -1.1599 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