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
2.3995 -0.8864 -0.3952 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7967 0.2059 -0.0212 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3503 0.2797 0.0715 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4947 -0.7717 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8542 -0.6005 -0.1006 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4453 0.5786 0.3002 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5962 1.5841 0.5770 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2666 1.4776 0.4795 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8914 -1.8078 -0.6619 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5033 -0.9154 -0.4574 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3783 1.0722 0.2245 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0689 -1.7315 -0.5437 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4809 -1.4625 -0.3428 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5245 0.6798 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4118 2.2980 0.7061 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