Monomers
3-Vinylpyridine
Identifiers
IUPAC name
3-ethenylpyridine
InchI
InChI=1S/C7H7N/c1-2-7-4-3-5-8-6-7/h2-6H,1H2
InchI Key
DPZYLEIWHTWHCU-UHFFFAOYSA-N
SMILES
C=Cc1cccnc1
Canonical SMILES
C=CC1=CN=CC=C1
Isomeric SMILES
C=CC1=CN=CC=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
2.6689 0.2523 -0.1895 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6420 -0.5628 -0.2723 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2582 -0.1443 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7672 -1.0749 -0.1629 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0631 -0.6653 0.0445 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3595 0.6519 0.3573 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3717 1.5516 0.4620 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0952 1.1488 0.2578 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6405 1.2885 0.0378 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6805 -0.1465 -0.3685 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8137 -1.6080 -0.5147 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5129 -2.0959 -0.4076 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8739 -1.3866 -0.0377 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3949 0.9219 0.5107 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7345 1.8691 0.3380 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
8 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers