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
-2.4955 0.6933 0.1059 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7665 -0.3352 -0.2102 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3240 -0.2990 -0.1206 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3896 0.7944 0.2951 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7916 0.7735 0.3629 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4612 -0.3749 0.0022 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7545 -1.4290 -0.3996 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4076 -1.4255 -0.4704 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0660 1.6072 0.4445 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5649 0.6375 0.0294 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2715 -1.2554 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0943 1.6938 0.5798 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3701 1.6264 0.6884 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5606 -0.4031 0.0513 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1526 -2.3039 -0.8037 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