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
2.6734 -0.0655 0.3378 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6521 -0.5511 -0.3294 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2920 -0.1277 -0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7534 -0.6819 -0.8331 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0317 -0.2773 -0.6013 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3824 0.6666 0.3399 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3690 1.1890 1.0446 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0762 0.8097 0.8416 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5503 0.6742 1.0987 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6733 -0.4161 0.1205 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8092 -1.3097 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4929 -1.4355 -1.5875 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8378 -0.7098 -1.1796 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4195 0.9583 0.4895 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7126 1.2767 1.4536 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