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
2.5787 0.0150 -0.4241 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6551 0.6524 0.2548 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2394 0.3126 0.2158 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2528 -0.7190 -0.5467 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6244 -1.0033 -0.5477 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5108 -0.2666 0.2064 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9971 0.7350 0.9406 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.6785 1.0281 0.9578 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3951 -0.8209 -1.0785 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6296 0.3318 -0.3423 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9818 1.4939 0.8896 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4383 -1.3031 -1.1426 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9958 -1.8171 -1.1521 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5875 -0.4868 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2711 1.8479 1.5610 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