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
2.7055 -0.1004 0.0563 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6332 0.5380 -0.3667 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2778 0.1312 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7889 0.8736 -0.5808 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0929 0.4992 -0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3948 -0.6191 0.4239 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3556 -1.3311 0.8955 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.0553 -0.9796 0.6550 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6404 -0.9898 0.6517 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7183 0.2381 -0.1743 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8049 1.4296 -0.9641 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5389 1.7513 -1.1687 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9064 1.0873 -0.7148 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4039 -0.9419 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7565 -1.5863 1.0572 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