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
-2.7132 0.4110 0.3493 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8934 -0.4945 -0.1123 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4536 -0.3363 -0.1262 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1823 0.7782 0.3437 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5772 0.9021 0.3168 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3369 -0.1259 -0.1969 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6697 -1.2400 -0.6647 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3390 -1.3211 -0.6222 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.3730 1.3450 0.7547 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7746 0.2325 0.3314 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3143 -1.4186 -0.5083 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3854 1.6050 0.7542 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0762 1.7891 0.6911 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4288 -0.0874 -0.2445 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2974 -2.0391 -1.0662 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